2-{4-[(3-ethoxypropyl)carbamoyl]piperidine-1-sulfonyl}-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylic acid
Chemical Structure Depiction of
2-{4-[(3-ethoxypropyl)carbamoyl]piperidine-1-sulfonyl}-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylic acid
2-{4-[(3-ethoxypropyl)carbamoyl]piperidine-1-sulfonyl}-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylic acid
Compound characteristics
| Compound ID: | C708-0501 |
| Compound Name: | 2-{4-[(3-ethoxypropyl)carbamoyl]piperidine-1-sulfonyl}-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylic acid |
| Molecular Weight: | 517.64 |
| Molecular Formula: | C26 H35 N3 O6 S |
| Smiles: | CCOCCCNC(C1CCN(CC1)S(c1ccc2c(c1)c(C(O)=O)c1CCCCCc1n2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3684 |
| logD: | 0.3396 |
| logSw: | -3.6256 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.945 |
| InChI Key: | FOCPFKRHRANARN-UHFFFAOYSA-N |