N'-(3-chloro-2-methylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]thiourea
Chemical Structure Depiction of
N'-(3-chloro-2-methylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]thiourea
N'-(3-chloro-2-methylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]thiourea
Compound characteristics
| Compound ID: | C087-0587 |
| Compound Name: | N'-(3-chloro-2-methylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]thiourea |
| Molecular Weight: | 391.96 |
| Molecular Formula: | C20 H26 Cl N3 O S |
| Smiles: | Cc1c(cccc1[Cl])NC(N(CCCN1CCCC1)Cc1ccco1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.0252 |
| logD: | 2.5285 |
| logSw: | -5.0369 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 21.8058 |
| InChI Key: | PTUIJFQLHHZTHF-UHFFFAOYSA-N |