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ChemicalBook--->CAS DataBase List--->960540-96-9

960540-96-9

960540-96-9 Structure

960540-96-9 Structure
IdentificationBack Directory
[Name]

[(1,3-Dicyclohexyl-2,4,6-trioxo-hexahydro-pyrimidine-5-carbonyl)-amino]-acetic acid ethyl ester
[CAS]

960540-96-9
[Synonyms]

Daprodustat Impurity 1
ethyl (1,3-dicyclohexyl-2,4,6-trioxohexahydropyrimidine-5-carbonyl)glycinate
Ethyl 2-(1,3-Dicyclohexyl-2,4,6-trioxohexahydropyrimidine-5-carboxamido)acetate
N-[(1,3-Dicyclohexylhexahydro-2,4,6-trioxo-5-pyrimidinyl)carbonyl]glycine ethyl ester
[(1,3-Dicyclohexyl-2,4,6-trioxo-hexahydro-pyrimidine-5-carbonyl)-amino]-acetic acid ethyl ester
[Molecular Formula]

C21H31N3O6
[MDL Number]

MFCD31620851
[MOL File]

960540-96-9.mol
[Molecular Weight]

421.49
Chemical PropertiesBack Directory
[density ]

1.272±0.06 g/cm3(Predicted)
[pka]

3.05±0.20(Predicted)
[InChI]

InChI=1S/C21H31N3O6/c1-2-30-16(25)13-22-18(26)17-19(27)23(14-9-5-3-6-10-14)21(29)24(20(17)28)15-11-7-4-8-12-15/h14-15,17H,2-13H2,1H3,(H,22,26)
[InChIKey]

ZMEZGLQQHLUGQB-UHFFFAOYSA-N
[SMILES]

C(OCC)(=O)CNC(C1C(=O)N(C2CCCCC2)C(=O)N(C2CCCCC2)C1=O)=O
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