2-methylpropyl 4-{4-[(2-bromophenyl)carbamamido]phenyl}-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2-methylpropyl 4-{4-[(2-bromophenyl)carbamamido]phenyl}-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2-methylpropyl 4-{4-[(2-bromophenyl)carbamamido]phenyl}-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | V014-9213 |
Compound Name: | 2-methylpropyl 4-{4-[(2-bromophenyl)carbamamido]phenyl}-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 543.46 |
Molecular Formula: | C26 H31 Br N4 O4 |
Smiles: | CCCN1C(C)=C(C(c2ccc(cc2)NC(Nc2ccccc2[Br])=O)NC1=O)C(=O)OCC(C)C |
Stereo: | RACEMIC MIXTURE |
logP: | 5.5599 |
logD: | 5.5597 |
logSw: | -5.5199 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 80.622 |
InChI Key: | DVJYVIJUEMWOJJ-QHCPKHFHSA-N |