4-tert-butyl-N-(6-{4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
Chemical Structure Depiction of
4-tert-butyl-N-(6-{4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
4-tert-butyl-N-(6-{4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide
Compound characteristics
| Compound ID: | V023-7938 |
| Compound Name: | 4-tert-butyl-N-(6-{4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)benzamide |
| Molecular Weight: | 456.63 |
| Molecular Formula: | C29 H36 N4 O |
| Salt: | not_available |
| Smiles: | Cc1ccc(CN2CCCN(CC2)c2ccc(cn2)NC(c2ccc(cc2)C(C)(C)C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.6879 |
| logD: | 6.2303 |
| logSw: | -5.4263 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.255 |
| InChI Key: | JWWMFAVVDJJZGR-UHFFFAOYSA-N |