N-[(1-methyl-1H-pyrrol-2-yl)methyl]-N'-[3-(methylsulfanyl)phenyl]thiourea
Chemical Structure Depiction of
N-[(1-methyl-1H-pyrrol-2-yl)methyl]-N'-[3-(methylsulfanyl)phenyl]thiourea
N-[(1-methyl-1H-pyrrol-2-yl)methyl]-N'-[3-(methylsulfanyl)phenyl]thiourea
Compound characteristics
| Compound ID: | K788-0599 |
| Compound Name: | N-[(1-methyl-1H-pyrrol-2-yl)methyl]-N'-[3-(methylsulfanyl)phenyl]thiourea |
| Molecular Weight: | 291.43 |
| Molecular Formula: | C14 H17 N3 S2 |
| Smiles: | Cn1cccc1CNC(Nc1cccc(c1)SC)=S |
| Stereo: | ACHIRAL |
| logP: | 3.2212 |
| logD: | 3.2212 |
| logSw: | -3.3286 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 23.2808 |
| InChI Key: | PNKJMIWUJQOLOZ-UHFFFAOYSA-N |