5-(4-chlorobenzoyl)-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
5-(4-chlorobenzoyl)-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
5-(4-chlorobenzoyl)-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | D428-0042 |
| Compound Name: | 5-(4-chlorobenzoyl)-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 314.77 |
| Molecular Formula: | C17 H15 Cl N2 O2 |
| Smiles: | CC1CN(C(c2ccc(cc2)[Cl])=O)c2ccccc2NC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2136 |
| logD: | 3.2085 |
| logSw: | -3.7296 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.773 |
| InChI Key: | JPRCINHPGWCUQB-NSHDSACASA-N |