N'-(3-chloro-2-methylphenyl)-N-[3-(4-ethylpiperazin-1-yl)propyl]-N-[(furan-2-yl)methyl]thiourea
Chemical Structure Depiction of
N'-(3-chloro-2-methylphenyl)-N-[3-(4-ethylpiperazin-1-yl)propyl]-N-[(furan-2-yl)methyl]thiourea
N'-(3-chloro-2-methylphenyl)-N-[3-(4-ethylpiperazin-1-yl)propyl]-N-[(furan-2-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C087-0591 |
| Compound Name: | N'-(3-chloro-2-methylphenyl)-N-[3-(4-ethylpiperazin-1-yl)propyl]-N-[(furan-2-yl)methyl]thiourea |
| Molecular Weight: | 435.03 |
| Molecular Formula: | C22 H31 Cl N4 O S |
| Smiles: | CCN1CCN(CCCN(Cc2ccco2)C(Nc2cccc(c2C)[Cl])=S)CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.5406 |
| logD: | 3.5924 |
| logSw: | -4.3948 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.9765 |
| InChI Key: | VQEOEOBHWYDDAJ-UHFFFAOYSA-N |