4-[1,2,5-trimethyl-4-(4-methylpiperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]-3,4-dihydroquinoxalin-2(1H)-one
Chemical Structure Depiction of
4-[1,2,5-trimethyl-4-(4-methylpiperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]-3,4-dihydroquinoxalin-2(1H)-one
4-[1,2,5-trimethyl-4-(4-methylpiperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]-3,4-dihydroquinoxalin-2(1H)-one
Compound characteristics
Compound ID: | G403-2727 |
Compound Name: | 4-[1,2,5-trimethyl-4-(4-methylpiperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]-3,4-dihydroquinoxalin-2(1H)-one |
Molecular Weight: | 444.55 |
Molecular Formula: | C22 H28 N4 O4 S |
Smiles: | CC1CCN(CC1)C(c1c(c(C)n(C)c1C)S(N1CC(Nc2ccccc12)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.5597 |
logD: | 1.5596 |
logSw: | -2.5312 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.652 |
InChI Key: | DTFYKJKWHHYNOZ-UHFFFAOYSA-N |