ethyl 4-({[3-(2-oxopyrrolidin-1-yl)propyl]carbamothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({[3-(2-oxopyrrolidin-1-yl)propyl]carbamothioyl}amino)benzoate
ethyl 4-({[3-(2-oxopyrrolidin-1-yl)propyl]carbamothioyl}amino)benzoate
Compound characteristics
| Compound ID: | 4038-0178 |
| Compound Name: | ethyl 4-({[3-(2-oxopyrrolidin-1-yl)propyl]carbamothioyl}amino)benzoate |
| Molecular Weight: | 349.45 |
| Molecular Formula: | C17 H23 N3 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(NCCCN1CCCC1=O)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7603 |
| logD: | 1.7603 |
| logSw: | -2.4364 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.491 |
| InChI Key: | RUKJBMKLUDSRCX-UHFFFAOYSA-N |