N-benzyl-N'-(4-chloro-2-methoxy-5-methylphenyl)-N-[(pyridin-3-yl)methyl]thiourea
Chemical Structure Depiction of
N-benzyl-N'-(4-chloro-2-methoxy-5-methylphenyl)-N-[(pyridin-3-yl)methyl]thiourea
N-benzyl-N'-(4-chloro-2-methoxy-5-methylphenyl)-N-[(pyridin-3-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C087-1266 |
| Compound Name: | N-benzyl-N'-(4-chloro-2-methoxy-5-methylphenyl)-N-[(pyridin-3-yl)methyl]thiourea |
| Molecular Weight: | 411.95 |
| Molecular Formula: | C22 H22 Cl N3 O S |
| Smiles: | Cc1cc(c(cc1[Cl])OC)NC(N(Cc1ccccc1)Cc1cccnc1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.0847 |
| logD: | 5.0841 |
| logSw: | -5.5588 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.8783 |
| InChI Key: | RWAMWNMUCVXYAP-UHFFFAOYSA-N |