4-tert-butyl-N-(6-{4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
Chemical Structure Depiction of
4-tert-butyl-N-(6-{4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
4-tert-butyl-N-(6-{4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
Compound characteristics
| Compound ID: | V023-8020 |
| Compound Name: | 4-tert-butyl-N-(6-{4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide |
| Molecular Weight: | 532.68 |
| Molecular Formula: | C31 H40 N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1ccc(nc1)N1CCCN(CC1)Cc1ccc(c(c1OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2123 |
| logD: | 5.2241 |
| logSw: | -5.3568 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.319 |
| InChI Key: | KLDXFAQWOMKYRV-UHFFFAOYSA-N |