N-{[2-(azepan-1-yl)pyridin-4-yl]methyl}-N'-(3,4,5-trimethoxyphenyl)urea
Chemical Structure Depiction of
N-{[2-(azepan-1-yl)pyridin-4-yl]methyl}-N'-(3,4,5-trimethoxyphenyl)urea
N-{[2-(azepan-1-yl)pyridin-4-yl]methyl}-N'-(3,4,5-trimethoxyphenyl)urea
Compound characteristics
| Compound ID: | L585-0433 |
| Compound Name: | N-{[2-(azepan-1-yl)pyridin-4-yl]methyl}-N'-(3,4,5-trimethoxyphenyl)urea |
| Molecular Weight: | 414.5 |
| Molecular Formula: | C22 H30 N4 O4 |
| Smiles: | COc1cc(cc(c1OC)OC)NC(NCc1ccnc(c1)N1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.328 |
| logD: | 3.3242 |
| logSw: | -3.5541 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.136 |
| InChI Key: | WLEZGNZFVNPXNZ-UHFFFAOYSA-N |