2-(azepan-1-yl)-6-[2-(4-methylphenyl)acetamido]quinoline-4-carboxylic acid--hydrogen chloride (1/2)
Chemical Structure Depiction of
2-(azepan-1-yl)-6-[2-(4-methylphenyl)acetamido]quinoline-4-carboxylic acid--hydrogen chloride (1/2)
2-(azepan-1-yl)-6-[2-(4-methylphenyl)acetamido]quinoline-4-carboxylic acid--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | F723-0155 |
| Compound Name: | 2-(azepan-1-yl)-6-[2-(4-methylphenyl)acetamido]quinoline-4-carboxylic acid--hydrogen chloride (1/2) |
| Molecular Weight: | 490.43 |
| Molecular Formula: | C25 H27 N3 O3 |
| Salt: | 2HCl |
| Smiles: | Cc1ccc(CC(Nc2ccc3c(c2)c(cc(n3)N2CCCCCC2)C(O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7572 |
| logD: | 2.8131 |
| logSw: | -5.3126 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.102 |
| InChI Key: | IZAGXPJNZNJFQD-UHFFFAOYSA-N |