N-{6-[4-(3-bromobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-phenylacetamide
Chemical Structure Depiction of
N-{6-[4-(3-bromobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-phenylacetamide
N-{6-[4-(3-bromobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-phenylacetamide
Compound characteristics
| Compound ID: | V021-9492 |
| Compound Name: | N-{6-[4-(3-bromobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-phenylacetamide |
| Molecular Weight: | 493.4 |
| Molecular Formula: | C25 H25 Br N4 O2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1ccc(cn1)NC(Cc1ccccc1)=O)C(c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5929 |
| logD: | 4.5914 |
| logSw: | -4.3502 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.957 |
| InChI Key: | WLQNGMMWGQHCLE-UHFFFAOYSA-N |