N-(3-chloro-4-methoxyphenyl)-N'-{[1-(1-phenylethyl)pyrrolidin-3-yl]methyl}thiourea
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-N'-{[1-(1-phenylethyl)pyrrolidin-3-yl]methyl}thiourea
N-(3-chloro-4-methoxyphenyl)-N'-{[1-(1-phenylethyl)pyrrolidin-3-yl]methyl}thiourea
Compound characteristics
| Compound ID: | K788-7752 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-N'-{[1-(1-phenylethyl)pyrrolidin-3-yl]methyl}thiourea |
| Molecular Weight: | 403.97 |
| Molecular Formula: | C21 H26 Cl N3 O S |
| Smiles: | CC(c1ccccc1)N1CCC(CNC(Nc2ccc(c(c2)[Cl])OC)=S)C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5589 |
| logD: | 1.5037 |
| logSw: | -4.7108 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 31.718 |
| InChI Key: | HACPGQGICGCOGG-UHFFFAOYSA-N |