methyl 1-butyl-4-{3-[(3-chloro-4-methylphenyl)carbamamido]phenyl}-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 1-butyl-4-{3-[(3-chloro-4-methylphenyl)carbamamido]phenyl}-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 1-butyl-4-{3-[(3-chloro-4-methylphenyl)carbamamido]phenyl}-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V014-3543 |
| Compound Name: | methyl 1-butyl-4-{3-[(3-chloro-4-methylphenyl)carbamamido]phenyl}-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 484.98 |
| Molecular Formula: | C25 H29 Cl N4 O4 |
| Smiles: | CCCCN1C(C)=C(C(c2cccc(c2)NC(Nc2ccc(C)c(c2)[Cl])=O)NC1=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1871 |
| logD: | 6.1855 |
| logSw: | -6.1485 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.365 |
| InChI Key: | VRTCASIKJMOPCC-QFIPXVFZSA-N |