N-{[2-(thiomorpholin-4-yl)pyridin-4-yl]methyl}-N'-(3,4,5-trimethoxyphenyl)urea
Chemical Structure Depiction of
N-{[2-(thiomorpholin-4-yl)pyridin-4-yl]methyl}-N'-(3,4,5-trimethoxyphenyl)urea
N-{[2-(thiomorpholin-4-yl)pyridin-4-yl]methyl}-N'-(3,4,5-trimethoxyphenyl)urea
Compound characteristics
| Compound ID: | L585-0625 |
| Compound Name: | N-{[2-(thiomorpholin-4-yl)pyridin-4-yl]methyl}-N'-(3,4,5-trimethoxyphenyl)urea |
| Molecular Weight: | 418.51 |
| Molecular Formula: | C20 H26 N4 O4 S |
| Smiles: | COc1cc(cc(c1OC)OC)NC(NCc1ccnc(c1)N1CCSCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2569 |
| logD: | 2.1661 |
| logSw: | -3.0809 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.805 |
| InChI Key: | OFUUNJPPXVARAE-UHFFFAOYSA-N |