ethyl 4-({[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]carbamothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]carbamothioyl}amino)benzoate
ethyl 4-({[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]carbamothioyl}amino)benzoate
Compound characteristics
| Compound ID: | 8017-9760 |
| Compound Name: | ethyl 4-({[1-(2-methyl-6-propylpyrimidin-4-yl)piperidin-4-yl]carbamothioyl}amino)benzoate |
| Molecular Weight: | 441.59 |
| Molecular Formula: | C23 H31 N5 O2 S |
| Smiles: | CCCc1cc(nc(C)n1)N1CCC(CC1)NC(Nc1ccc(cc1)C(=O)OCC)=S |
| Stereo: | ACHIRAL |
| logP: | 5.322 |
| logD: | 5.2854 |
| logSw: | -5.3123 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.265 |
| InChI Key: | RZELTGIHQUMONU-UHFFFAOYSA-N |