9-[4-(4-methylbenzene-1-sulfonyl)piperazine-1-sulfonyl]-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-5-one
Chemical Structure Depiction of
9-[4-(4-methylbenzene-1-sulfonyl)piperazine-1-sulfonyl]-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-5-one
9-[4-(4-methylbenzene-1-sulfonyl)piperazine-1-sulfonyl]-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-5-one
Compound characteristics
Compound ID: | G425-0076 |
Compound Name: | 9-[4-(4-methylbenzene-1-sulfonyl)piperazine-1-sulfonyl]-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-5-one |
Molecular Weight: | 489.61 |
Molecular Formula: | C23 H27 N3 O5 S2 |
Smiles: | Cc1ccc(cc1)S(N1CCN(CC1)S(c1cc2CCCN3C(CCc(c1)c23)=O)(=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.9763 |
logD: | 2.9763 |
logSw: | -3.3471 |
Hydrogen bond acceptors count: | 12 |
Polar surface area: | 80.705 |
InChI Key: | DJFUSWTXKCOBSP-UHFFFAOYSA-N |