N-(3-chlorophenyl)-2-{[4-(3-methoxybenzoyl)-1,4-diazepan-1-yl]methyl}morpholine-4-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-{[4-(3-methoxybenzoyl)-1,4-diazepan-1-yl]methyl}morpholine-4-carboxamide
N-(3-chlorophenyl)-2-{[4-(3-methoxybenzoyl)-1,4-diazepan-1-yl]methyl}morpholine-4-carboxamide
Compound characteristics
| Compound ID: | V028-6727 |
| Compound Name: | N-(3-chlorophenyl)-2-{[4-(3-methoxybenzoyl)-1,4-diazepan-1-yl]methyl}morpholine-4-carboxamide |
| Molecular Weight: | 487 |
| Molecular Formula: | C25 H31 Cl N4 O4 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(N1CCCN(CC1)CC1CN(CCO1)C(Nc1cccc(c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9355 |
| logD: | 2.9229 |
| logSw: | -3.6344 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.801 |
| InChI Key: | WMKQNYJJDUJFIE-QHCPKHFHSA-N |