N-benzyl-N'-[3-(methylsulfanyl)phenyl]-N-[(pyridin-3-yl)methyl]thiourea
Chemical Structure Depiction of
N-benzyl-N'-[3-(methylsulfanyl)phenyl]-N-[(pyridin-3-yl)methyl]thiourea
N-benzyl-N'-[3-(methylsulfanyl)phenyl]-N-[(pyridin-3-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C087-1368 |
| Compound Name: | N-benzyl-N'-[3-(methylsulfanyl)phenyl]-N-[(pyridin-3-yl)methyl]thiourea |
| Molecular Weight: | 379.54 |
| Molecular Formula: | C21 H21 N3 S2 |
| Smiles: | CSc1cccc(c1)NC(N(Cc1ccccc1)Cc1cccnc1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.251 |
| logD: | 4.2504 |
| logSw: | -4.1273 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 19.9457 |
| InChI Key: | HXZQQCFDMZFDQE-UHFFFAOYSA-N |