N-{[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl}-N'-[3-(methylsulfanyl)phenyl]thiourea
Chemical Structure Depiction of
N-{[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl}-N'-[3-(methylsulfanyl)phenyl]thiourea
N-{[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl}-N'-[3-(methylsulfanyl)phenyl]thiourea
Compound characteristics
| Compound ID: | K788-1659 |
| Compound Name: | N-{[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl}-N'-[3-(methylsulfanyl)phenyl]thiourea |
| Molecular Weight: | 387.56 |
| Molecular Formula: | C20 H25 N3 O S2 |
| Smiles: | COc1ccc(cc1)N1CCC(CNC(Nc2cccc(c2)SC)=S)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4265 |
| logD: | 4.4232 |
| logSw: | -4.3421 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 31.679 |
| InChI Key: | JGZAQWXZHMDCAS-OAHLLOKOSA-N |