3-chloro-N-[5-(4-methylpiperidine-1-carbonyl)-6-(piperazin-1-yl)pyridin-3-yl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-chloro-N-[5-(4-methylpiperidine-1-carbonyl)-6-(piperazin-1-yl)pyridin-3-yl]benzamide--trifluoroacetic acid (1/1)
3-chloro-N-[5-(4-methylpiperidine-1-carbonyl)-6-(piperazin-1-yl)pyridin-3-yl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
Compound ID: | L347-0394 |
Compound Name: | 3-chloro-N-[5-(4-methylpiperidine-1-carbonyl)-6-(piperazin-1-yl)pyridin-3-yl]benzamide--trifluoroacetic acid (1/1) |
Molecular Weight: | 555.98 |
Molecular Formula: | C23 H28 Cl N5 O2 |
Salt: | CF3COOH |
Smiles: | CC1CCN(CC1)C(c1cc(cnc1N1CCNCC1)NC(c1cccc(c1)[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 3.329 |
logD: | 1.8509 |
logSw: | -3.7453 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 64.462 |
InChI Key: | WTGRCLUNPDXPIC-UHFFFAOYSA-N |