3-methoxy-N-(6-{4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
Chemical Structure Depiction of
3-methoxy-N-(6-{4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
3-methoxy-N-(6-{4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
Compound characteristics
| Compound ID: | V016-0029 |
| Compound Name: | 3-methoxy-N-(6-{4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide |
| Molecular Weight: | 506.6 |
| Molecular Formula: | C28 H34 N4 O5 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(Nc1ccc(nc1)N1CCCN(CC1)Cc1ccc(c(c1OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.48 |
| logD: | 3.4918 |
| logSw: | -4.2109 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.863 |
| InChI Key: | HQZJLYDJRDIDJJ-UHFFFAOYSA-N |