N-(3-chloro-4-fluorophenyl)-N'-{[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl}thiourea
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-N'-{[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl}thiourea
N-(3-chloro-4-fluorophenyl)-N'-{[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl}thiourea
Compound characteristics
| Compound ID: | K788-2070 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-N'-{[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl}thiourea |
| Molecular Weight: | 393.91 |
| Molecular Formula: | C19 H21 Cl F N3 O S |
| Smiles: | COc1ccc(cc1)N1CCC(CNC(Nc2ccc(c(c2)[Cl])F)=S)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6957 |
| logD: | 4.6923 |
| logSw: | -4.917 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 31.679 |
| InChI Key: | MWDVYXSXMJTYEX-CYBMUJFWSA-N |