ethyl 4-({(propan-2-yl)[2-(pyridin-4-yl)ethyl]carbamothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({(propan-2-yl)[2-(pyridin-4-yl)ethyl]carbamothioyl}amino)benzoate
ethyl 4-({(propan-2-yl)[2-(pyridin-4-yl)ethyl]carbamothioyl}amino)benzoate
Compound characteristics
| Compound ID: | K788-7536 |
| Compound Name: | ethyl 4-({(propan-2-yl)[2-(pyridin-4-yl)ethyl]carbamothioyl}amino)benzoate |
| Molecular Weight: | 371.5 |
| Molecular Formula: | C20 H25 N3 O2 S |
| Smiles: | CCOC(c1ccc(cc1)NC(N(CCc1ccncc1)C(C)C)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2204 |
| logD: | 4.1755 |
| logSw: | -3.9244 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.604 |
| InChI Key: | DTJZLXCAZIFBBK-UHFFFAOYSA-N |