ethyl 4-({[3-(morpholin-4-yl)propyl][(pyridin-3-yl)methyl]carbamothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({[3-(morpholin-4-yl)propyl][(pyridin-3-yl)methyl]carbamothioyl}amino)benzoate
ethyl 4-({[3-(morpholin-4-yl)propyl][(pyridin-3-yl)methyl]carbamothioyl}amino)benzoate
Compound characteristics
| Compound ID: | C087-0148 |
| Compound Name: | ethyl 4-({[3-(morpholin-4-yl)propyl][(pyridin-3-yl)methyl]carbamothioyl}amino)benzoate |
| Molecular Weight: | 442.58 |
| Molecular Formula: | C23 H30 N4 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(N(CCCN1CCOCC1)Cc1cccnc1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8894 |
| logD: | 2.7372 |
| logSw: | -2.9915 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.569 |
| InChI Key: | YNJJYYOIGWXGIM-UHFFFAOYSA-N |