N-tert-butyl-N'-(6-{4-[(2-methoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)urea
Chemical Structure Depiction of
N-tert-butyl-N'-(6-{4-[(2-methoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)urea
N-tert-butyl-N'-(6-{4-[(2-methoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)urea
Compound characteristics
| Compound ID: | V027-4819 |
| Compound Name: | N-tert-butyl-N'-(6-{4-[(2-methoxyphenyl)methyl]-1,4-diazepan-1-yl}pyridin-3-yl)urea |
| Molecular Weight: | 411.55 |
| Molecular Formula: | C23 H33 N5 O2 |
| Smiles: | CC(C)(C)NC(Nc1ccc(nc1)N1CCCN(CC1)Cc1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6156 |
| logD: | 4.4198 |
| logSw: | -4.1186 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.514 |
| InChI Key: | JYZCHEDJDPKYFL-UHFFFAOYSA-N |