N'-(3,5-dimethylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]thiourea
Chemical Structure Depiction of
N'-(3,5-dimethylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]thiourea
N'-(3,5-dimethylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]thiourea
Compound characteristics
| Compound ID: | C087-1301 |
| Compound Name: | N'-(3,5-dimethylphenyl)-N-[(furan-2-yl)methyl]-N-[3-(pyrrolidin-1-yl)propyl]thiourea |
| Molecular Weight: | 371.54 |
| Molecular Formula: | C21 H29 N3 O S |
| Smiles: | Cc1cc(C)cc(c1)NC(N(CCCN1CCCC1)Cc1ccco1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.5672 |
| logD: | 2.0705 |
| logSw: | -4.2807 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.5036 |
| InChI Key: | BNDDNVSRHBNKKG-UHFFFAOYSA-N |