2-(2H-1,3-benzodioxol-5-yl)-7-chloro-8-methyl-N-[(thiophen-2-yl)methyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-7-chloro-8-methyl-N-[(thiophen-2-yl)methyl]quinoline-4-carboxamide
2-(2H-1,3-benzodioxol-5-yl)-7-chloro-8-methyl-N-[(thiophen-2-yl)methyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y200-1223 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-7-chloro-8-methyl-N-[(thiophen-2-yl)methyl]quinoline-4-carboxamide |
| Molecular Weight: | 436.92 |
| Molecular Formula: | C23 H17 Cl N2 O3 S |
| Smiles: | Cc1c(ccc2c(cc(c3ccc4c(c3)OCO4)nc12)C(NCc1cccs1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.5748 |
| logD: | 6.5696 |
| logSw: | -6.2169 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.615 |
| InChI Key: | GYSBWSAIVSBIDY-UHFFFAOYSA-N |