1-[(4-chlorophenyl)methyl]-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
1-[(4-chlorophenyl)methyl]-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | D428-0153 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 300.79 |
| Molecular Formula: | C17 H17 Cl N2 O |
| Smiles: | CC1CNc2ccccc2N(Cc2ccc(cc2)[Cl])C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7419 |
| logD: | 3.7419 |
| logSw: | -4.2889 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.1616 |
| InChI Key: | MPBIKFGCPVQWFM-LBPRGKRZSA-N |