5-[(2,4-dichlorophenoxy)acetyl]-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
5-[(2,4-dichlorophenoxy)acetyl]-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
5-[(2,4-dichlorophenoxy)acetyl]-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | D479-0196 |
| Compound Name: | 5-[(2,4-dichlorophenoxy)acetyl]-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 379.24 |
| Molecular Formula: | C18 H16 Cl2 N2 O3 |
| Smiles: | CC1CN(C(COc2ccc(cc2[Cl])[Cl])=O)c2ccccc2NC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5039 |
| logD: | 3.4518 |
| logSw: | -3.8165 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.831 |
| InChI Key: | QAFKXIKHWRGNGT-NSHDSACASA-N |