3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-ethyl-6-(piperidine-1-sulfonyl)quinolin-4(1H)-one
Chemical Structure Depiction of
3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-ethyl-6-(piperidine-1-sulfonyl)quinolin-4(1H)-one
3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-ethyl-6-(piperidine-1-sulfonyl)quinolin-4(1H)-one
Compound characteristics
| Compound ID: | C519-1382 |
| Compound Name: | 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1-ethyl-6-(piperidine-1-sulfonyl)quinolin-4(1H)-one |
| Molecular Weight: | 543.08 |
| Molecular Formula: | C27 H31 Cl N4 O4 S |
| Smiles: | CCN1C=C(C(c2cc(ccc12)S(N1CCCCC1)(=O)=O)=O)C(N1CCN(CC1)c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5099 |
| logD: | 3.5098 |
| logSw: | -3.8153 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.178 |
| InChI Key: | VABWOFBRKSREKS-UHFFFAOYSA-N |