1-methyl-6-(4-methylpiperidine-1-sulfonyl)-3-(pyrrolidine-1-carbonyl)quinolin-4(1H)-one
Chemical Structure Depiction of
1-methyl-6-(4-methylpiperidine-1-sulfonyl)-3-(pyrrolidine-1-carbonyl)quinolin-4(1H)-one
1-methyl-6-(4-methylpiperidine-1-sulfonyl)-3-(pyrrolidine-1-carbonyl)quinolin-4(1H)-one
Compound characteristics
Compound ID: | C519-0745 |
Compound Name: | 1-methyl-6-(4-methylpiperidine-1-sulfonyl)-3-(pyrrolidine-1-carbonyl)quinolin-4(1H)-one |
Molecular Weight: | 417.53 |
Molecular Formula: | C21 H27 N3 O4 S |
Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)C(C(=CN2C)C(N1CCCC1)=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.8512 |
logD: | 1.8512 |
logSw: | -2.8675 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 64.274 |
InChI Key: | PCCIECLUMGKAKK-UHFFFAOYSA-N |