N'-(4-chloro-3-methylphenyl)-N-[3-(pyrrolidin-1-yl)propyl]-N-[(thiophen-2-yl)methyl]thiourea
Chemical Structure Depiction of
N'-(4-chloro-3-methylphenyl)-N-[3-(pyrrolidin-1-yl)propyl]-N-[(thiophen-2-yl)methyl]thiourea
N'-(4-chloro-3-methylphenyl)-N-[3-(pyrrolidin-1-yl)propyl]-N-[(thiophen-2-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C087-0314 |
| Compound Name: | N'-(4-chloro-3-methylphenyl)-N-[3-(pyrrolidin-1-yl)propyl]-N-[(thiophen-2-yl)methyl]thiourea |
| Molecular Weight: | 408.03 |
| Molecular Formula: | C20 H26 Cl N3 S2 |
| Smiles: | Cc1cc(ccc1[Cl])NC(N(CCCN1CCCC1)Cc1cccs1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.5292 |
| logD: | 3.0325 |
| logSw: | -6.0201 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 15.7732 |
| InChI Key: | UNNQLMGEQXCUPF-UHFFFAOYSA-N |