N-{6-[4-(3-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-phenylacetamide
Chemical Structure Depiction of
N-{6-[4-(3-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-phenylacetamide
N-{6-[4-(3-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-phenylacetamide
Compound characteristics
| Compound ID: | V020-0812 |
| Compound Name: | N-{6-[4-(3-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-phenylacetamide |
| Molecular Weight: | 448.95 |
| Molecular Formula: | C25 H25 Cl N4 O2 |
| Smiles: | C1CN(CCN(C1)c1ccc(cn1)NC(Cc1ccccc1)=O)C(c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4068 |
| logD: | 4.4053 |
| logSw: | -4.4747 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.957 |
| InChI Key: | CVKFVWDWEMXUNO-UHFFFAOYSA-N |