6-(azepane-1-sulfonyl)-2-(pyridin-3-yl)-N-[2-(pyrrolidin-1-yl)ethyl]quinoline-4-carboxamide
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-2-(pyridin-3-yl)-N-[2-(pyrrolidin-1-yl)ethyl]quinoline-4-carboxamide
6-(azepane-1-sulfonyl)-2-(pyridin-3-yl)-N-[2-(pyrrolidin-1-yl)ethyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-1381 |
| Compound Name: | 6-(azepane-1-sulfonyl)-2-(pyridin-3-yl)-N-[2-(pyrrolidin-1-yl)ethyl]quinoline-4-carboxamide |
| Molecular Weight: | 507.65 |
| Molecular Formula: | C27 H33 N5 O3 S |
| Smiles: | C1CCCN(CC1)S(c1ccc2c(c1)c(cc(c1cccnc1)n2)C(NCCN1CCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7028 |
| logD: | 2.2946 |
| logSw: | -3.8888 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.461 |
| InChI Key: | VMBKVEXEJDCASV-UHFFFAOYSA-N |