N'-(4-chloro-2-methoxy-5-methylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]thiourea
Chemical Structure Depiction of
N'-(4-chloro-2-methoxy-5-methylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]thiourea
N'-(4-chloro-2-methoxy-5-methylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]thiourea
Compound characteristics
| Compound ID: | C087-1250 |
| Compound Name: | N'-(4-chloro-2-methoxy-5-methylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]thiourea |
| Molecular Weight: | 421.99 |
| Molecular Formula: | C21 H28 Cl N3 O2 S |
| Smiles: | Cc1cc(c(cc1[Cl])OC)NC(N(CCCN1CCCC1)Cc1ccco1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.1688 |
| logD: | 2.6721 |
| logSw: | -5.7088 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.4362 |
| InChI Key: | GMESPVSBMJYJMW-UHFFFAOYSA-N |