N-(3-chlorophenyl)-2-{[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]methyl}morpholine-4-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-{[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]methyl}morpholine-4-carboxamide
N-(3-chlorophenyl)-2-{[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]methyl}morpholine-4-carboxamide
Compound characteristics
| Compound ID: | V013-2953 |
| Compound Name: | N-(3-chlorophenyl)-2-{[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]methyl}morpholine-4-carboxamide |
| Molecular Weight: | 471 |
| Molecular Formula: | C25 H31 Cl N4 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(N1CCCN(CC1)CC1CN(CCO1)C(Nc1cccc(c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3808 |
| logD: | 3.351 |
| logSw: | -3.7475 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.257 |
| InChI Key: | BJZKVQRNDDBXSW-QHCPKHFHSA-N |