6-benzamido-2-{4-[(2-methoxyphenyl)methyl]piperazin-1-yl}quinoline-4-carboxylic acid--hydrogen chloride (1/3)
Chemical Structure Depiction of
6-benzamido-2-{4-[(2-methoxyphenyl)methyl]piperazin-1-yl}quinoline-4-carboxylic acid--hydrogen chloride (1/3)
6-benzamido-2-{4-[(2-methoxyphenyl)methyl]piperazin-1-yl}quinoline-4-carboxylic acid--hydrogen chloride (1/3)
Compound characteristics
| Compound ID: | F724-0528 |
| Compound Name: | 6-benzamido-2-{4-[(2-methoxyphenyl)methyl]piperazin-1-yl}quinoline-4-carboxylic acid--hydrogen chloride (1/3) |
| Molecular Weight: | 605.95 |
| Molecular Formula: | C29 H28 N4 O4 |
| Salt: | 3HCl |
| Smiles: | COc1ccccc1CN1CCN(CC1)c1cc(C(O)=O)c2cc(ccc2n1)NC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2664 |
| logD: | 2.3223 |
| logSw: | -5.2351 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.155 |
| InChI Key: | SAFQPWGRKNWBMW-UHFFFAOYSA-N |