N-[(2-chloropyridin-3-yl)carbamothioyl]-3,4,5-triethoxybenzamide
Chemical Structure Depiction of
N-[(2-chloropyridin-3-yl)carbamothioyl]-3,4,5-triethoxybenzamide
N-[(2-chloropyridin-3-yl)carbamothioyl]-3,4,5-triethoxybenzamide
Compound characteristics
| Compound ID: | C200-1430 |
| Compound Name: | N-[(2-chloropyridin-3-yl)carbamothioyl]-3,4,5-triethoxybenzamide |
| Molecular Weight: | 423.92 |
| Molecular Formula: | C19 H22 Cl N3 O4 S |
| Smiles: | CCOc1cc(cc(c1OCC)OCC)C(NC(Nc1cccnc1[Cl])=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6218 |
| logD: | 3.6215 |
| logSw: | -4.0016 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.944 |
| InChI Key: | SWAKATMFBXLMNE-UHFFFAOYSA-N |