6-methyl-3-[1-(2,4,5-trimethylbenzene-1-sulfonyl)piperidin-4-yl]quinazolin-4(3H)-one
Chemical Structure Depiction of
6-methyl-3-[1-(2,4,5-trimethylbenzene-1-sulfonyl)piperidin-4-yl]quinazolin-4(3H)-one
6-methyl-3-[1-(2,4,5-trimethylbenzene-1-sulfonyl)piperidin-4-yl]quinazolin-4(3H)-one
Compound characteristics
Compound ID: | L486-1222 |
Compound Name: | 6-methyl-3-[1-(2,4,5-trimethylbenzene-1-sulfonyl)piperidin-4-yl]quinazolin-4(3H)-one |
Molecular Weight: | 425.55 |
Molecular Formula: | C23 H27 N3 O3 S |
Smiles: | Cc1ccc2c(c1)C(N(C=N2)C1CCN(CC1)S(c1cc(C)c(C)cc1C)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1811 |
logD: | 4.1811 |
logSw: | -4.2702 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 57.245 |
InChI Key: | PLQBYTVPIWBAMB-UHFFFAOYSA-N |