5-[(4-chlorophenoxy)acetyl]-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
5-[(4-chlorophenoxy)acetyl]-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
5-[(4-chlorophenoxy)acetyl]-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | D479-0194 |
| Compound Name: | 5-[(4-chlorophenoxy)acetyl]-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 330.77 |
| Molecular Formula: | C17 H15 Cl N2 O3 |
| Smiles: | C1CN(C(COc2ccc(cc2)[Cl])=O)c2ccccc2NC1=O |
| Stereo: | ACHIRAL |
| logP: | 2.4392 |
| logD: | 2.4093 |
| logSw: | -3.1835 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.754 |
| InChI Key: | QXXBSPCRHCFHNX-UHFFFAOYSA-N |