7-bromo-4-[(4-fluorophenyl)acetyl]-5-phenyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Chemical Structure Depiction of
7-bromo-4-[(4-fluorophenyl)acetyl]-5-phenyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
7-bromo-4-[(4-fluorophenyl)acetyl]-5-phenyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Compound characteristics
Compound ID: | C076-0587 |
Compound Name: | 7-bromo-4-[(4-fluorophenyl)acetyl]-5-phenyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one |
Molecular Weight: | 453.31 |
Molecular Formula: | C23 H18 Br F N2 O2 |
Smiles: | C(C(N1CC(Nc2ccc(cc2C1c1ccccc1)[Br])=O)=O)c1ccc(cc1)F |
Stereo: | RACEMIC MIXTURE |
logP: | 4.7788 |
logD: | 4.7788 |
logSw: | -4.7586 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.499 |
InChI Key: | SSHOIXXDLVNRKG-QHCPKHFHSA-N |