ethyl 2-[(4-phenyl-3,6-dihydropyridine-1(2H)-carbothioyl)amino]benzoate
Chemical Structure Depiction of
ethyl 2-[(4-phenyl-3,6-dihydropyridine-1(2H)-carbothioyl)amino]benzoate
ethyl 2-[(4-phenyl-3,6-dihydropyridine-1(2H)-carbothioyl)amino]benzoate
Compound characteristics
| Compound ID: | C200-1859 |
| Compound Name: | ethyl 2-[(4-phenyl-3,6-dihydropyridine-1(2H)-carbothioyl)amino]benzoate |
| Molecular Weight: | 366.48 |
| Molecular Formula: | C21 H22 N2 O2 S |
| Smiles: | CCOC(c1ccccc1NC(N1CCC(=CC1)c1ccccc1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2772 |
| logD: | 5.2771 |
| logSw: | -5.1749 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.921 |
| InChI Key: | LQTKBRXUTOMTBD-UHFFFAOYSA-N |