N'-(3-chloro-4-methylphenyl)-N-[3-(4-methylpiperazin-1-yl)propyl]-N-[(thiophen-2-yl)methyl]thiourea
Chemical Structure Depiction of
N'-(3-chloro-4-methylphenyl)-N-[3-(4-methylpiperazin-1-yl)propyl]-N-[(thiophen-2-yl)methyl]thiourea
N'-(3-chloro-4-methylphenyl)-N-[3-(4-methylpiperazin-1-yl)propyl]-N-[(thiophen-2-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C087-0209 |
| Compound Name: | N'-(3-chloro-4-methylphenyl)-N-[3-(4-methylpiperazin-1-yl)propyl]-N-[(thiophen-2-yl)methyl]thiourea |
| Molecular Weight: | 437.07 |
| Molecular Formula: | C21 H29 Cl N4 S2 |
| Smiles: | Cc1ccc(cc1[Cl])NC(N(CCCN1CCN(C)CC1)Cc1cccs1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.8597 |
| logD: | 4.045 |
| logSw: | -4.9039 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 18.8838 |
| InChI Key: | KOHBQYDHKLQZEW-UHFFFAOYSA-N |