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[ CAS No. 24316-19-6 ] {[proInfo.proName]}

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Cat. No.: {[proInfo.prAm]}
HazMat Fee +

There will be a HazMat fee per item when shipping a dangerous goods. The HazMat fee will be charged to your UPS/DHL/FedEx collect account or added to the invoice unless the package is shipped via Ground service. Ship by air in Excepted Quantity (each bottle), which is up to 1g/1mL for class 6.1 packing group I or II, and up to 25g/25ml for all other HazMat items.

Type HazMat fee for 500 gram (Estimated)
Excepted Quantity USD 0.00
Limited Quantity USD 15-60
Inaccessible (Haz class 6.1), Domestic USD 80+
Inaccessible (Haz class 6.1), International USD 150+
Accessible (Haz class 3, 4, 5 or 8), Domestic USD 100+
Accessible (Haz class 3, 4, 5 or 8), International USD 200+
Chemical Structure| 24316-19-6
Chemical Structure| 24316-19-6
Structure of 24316-19-6 * Storage: {[proInfo.prStorage]}

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Quality Control of [ 24316-19-6 ]

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Product Citations

Product Details of [ 24316-19-6 ]

CAS No. :24316-19-6 MDL No. :MFCD00063372
Formula : C18H21NO4 Boiling Point : -
Linear Structure Formula :- InChI Key :YMNCVRSYJBNGLD-KURKYZTESA-N
M.W : 315.36 Pubchem ID :65305
Synonyms :
(-)-Cephalotaxine;ZINC19795976;(-)-Cephalotaxine, Alkaloid A from Cephalotaxus, Cephalotaxine;NSC 245454;NSC 128487;(–)-Cephalotaxine;Cephalotaxine
Chemical Name :(1S,3aR,14bS)-2-Methoxy-1,5,6,8,9,14b-hexahydro-4H-[1,3]dioxolo[4',5':4,5]benzo[1,2-d]cyclopenta[b]pyrrolo[1,2-a]azepin-1-ol

Calculated chemistry of [ 24316-19-6 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 23
Num. arom. heavy atoms : 6
Fraction Csp3 : 0.56
Num. rotatable bonds : 1
Num. H-bond acceptors : 5.0
Num. H-bond donors : 1.0
Molar Refractivity : 87.98
TPSA : 51.16 ?2

Pharmacokinetics

GI absorption : High
BBB permeant : Yes
P-gp substrate : Yes
CYP1A2 inhibitor : No
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : Yes
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -8.07 cm/s

Lipophilicity

Log Po/w (iLOGP) : 3.02
Log Po/w (XLOGP3) : 0.21
Log Po/w (WLOGP) : 1.41
Log Po/w (MLOGP) : 1.56
Log Po/w (SILICOS-IT) : 2.0
Consensus Log Po/w : 1.64

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 0.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : -2.05
Solubility : 2.78 mg/ml ; 0.00882 mol/l
Class : Soluble
Log S (Ali) : -0.84
Solubility : 45.2 mg/ml ; 0.143 mol/l
Class : Very soluble
Log S (SILICOS-IT) : -3.07
Solubility : 0.269 mg/ml ; 0.000853 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 0.0 alert
Leadlikeness : 0.0
Synthetic accessibility : 4.81

Safety of [ 24316-19-6 ]

Signal Word:Danger Class:6.1
Precautionary Statements:P501-P270-P264-P301+P310+P330-P405 UN#:2811
Hazard Statements:H301 Packing Group:Ⅲ
GHS Pictogram:

Application In Synthesis of [ 24316-19-6 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 24316-19-6 ]

[ 24316-19-6 ] Synthesis Path-Downstream   1~12

  • 1
  • [ 59-67-6 ]
  • [ 67-56-1 ]
  • [ 24316-19-6 ]
  • [ 61568-67-0 ]
  • 2
  • [ 541-41-3 ]
  • [ 24316-19-6 ]
  • [ 61568-72-7 ]
  • 3
  • [ 98-88-4 ]
  • [ 24316-19-6 ]
  • [ 61568-68-1 ]
  • 4
  • [ 4755-77-5 ]
  • [ 24316-19-6 ]
  • [ 61568-56-7 ]
  • 5
  • [ 501-53-1 ]
  • [ 24316-19-6 ]
  • [ 61568-71-6 ]
  • 6
  • [ 68423-50-7 ]
  • [ 24316-19-6 ]
  • [ 68423-51-8 ]
  • 7
  • [ 110-44-1 ]
  • [ 24316-19-6 ]
  • [ 61568-65-8 ]
  • 8
  • [ 4282-26-2 ]
  • [ 24316-19-6 ]
  • [ 61568-66-9 ]
  • 9
  • [ 67938-54-9 ]
  • [ 24316-19-6 ]
  • [ 62630-97-1 ]
  • 10
  • [ 3878-55-5 ]
  • [ 24316-19-6 ]
  • [ 61568-57-8 ]
  • 11
  • [ 2756-87-8 ]
  • [ 24316-19-6 ]
  • [ 61568-73-8 ]
  • 12
  • [ 10085-20-8 ]
  • [ 24316-19-6 ]
  • [ 61568-60-3 ]
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