518048-02-7
BENZYL [1-[4-[[(4-FLUOROBENZYL)AMINO]CARBONYL]-5-HYDROXY-1-METHYL-6-OXO-1,6-DIHYDROPYRIMIDIN-2-YL]-1-METHYLETHYL]CARBAMATE

InChI=1S/C24H25FN4O5/c1-24(2,28-23(33)34-14-16-7-5-4-6-8-16)22-27-18(19(30)21(32)29(22)3)20(31)26-13-15-9-11-17(25)12-10-15/h4-12,30H,13-14H2,1-3H3,(H,26,31)(H,28,33)

【InChIKey】

InChIKey=YSQDMQRPJOGQNV-UHFFFAOYSA-N

【SMILES】

CC(C)(c1nc(c(c(=O)n1C)O)C(=O)NCc2ccc(cc2)F)NC(=O)OCc3ccccc3

【MOL File】

BENZYL [1-[4-[[(4-FL….mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:3

H bond acceptor:9

XLogP3:2.0

Bulk/Fine:FB

3Material Safety Data Sheet(MSDS)

4CML File

BENZYL [1-[4-[[(4-FLUOROBENZYL)AMINO]CARBONYL]-5-HYDROXY-1-METHYL-6-OXO-1,6-DIHYDROPYRIMIDIN-2-YL]-1-METHYLETHYL]CARBAMATE.cml

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518048-02-7 BENZYL [1-[4-[[(4-FLUOROBENZYL)AMINO]CARBONYL]-5-HYDROXY-1-METHYL-6-OXO-1,6-DIHYDROPYRIMIDIN-2-YL]-1-METHYLETHYL]CARBAMATE

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】