5-(4-chlorobenzoyl)-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
5-(4-chlorobenzoyl)-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
5-(4-chlorobenzoyl)-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | D428-0071 |
| Compound Name: | 5-(4-chlorobenzoyl)-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 314.77 |
| Molecular Formula: | C17 H15 Cl N2 O2 |
| Smiles: | CC1CC(Nc2ccccc2N1C(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8479 |
| logD: | 2.8436 |
| logSw: | -3.6178 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.721 |
| InChI Key: | AWSHPZVBAHWGDS-NSHDSACASA-N |