methyl 6-{4-[4-(morpholine-4-carbonyl)-2-nitrophenyl]piperazine-1-sulfonyl}-3,4-dihydroquinoline-1(2H)-carboxylate
Chemical Structure Depiction of
methyl 6-{4-[4-(morpholine-4-carbonyl)-2-nitrophenyl]piperazine-1-sulfonyl}-3,4-dihydroquinoline-1(2H)-carboxylate
methyl 6-{4-[4-(morpholine-4-carbonyl)-2-nitrophenyl]piperazine-1-sulfonyl}-3,4-dihydroquinoline-1(2H)-carboxylate
Compound characteristics
| Compound ID: | 8018-3714 |
| Compound Name: | methyl 6-{4-[4-(morpholine-4-carbonyl)-2-nitrophenyl]piperazine-1-sulfonyl}-3,4-dihydroquinoline-1(2H)-carboxylate |
| Molecular Weight: | 573.62 |
| Molecular Formula: | C26 H31 N5 O8 S |
| Smiles: | COC(N1CCCc2cc(ccc12)S(N1CCN(CC1)c1ccc(cc1[N+]([O-])=O)C(N1CCOCC1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8861 |
| logD: | 1.8861 |
| logSw: | -2.6587 |
| Hydrogen bond acceptors count: | 15 |
| Polar surface area: | 114.603 |
| InChI Key: | WBGNVSKMHYACHD-UHFFFAOYSA-N |