3-[1-(2,4,5-trimethylbenzene-1-sulfonyl)piperidin-4-yl]quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[1-(2,4,5-trimethylbenzene-1-sulfonyl)piperidin-4-yl]quinazolin-4(3H)-one
3-[1-(2,4,5-trimethylbenzene-1-sulfonyl)piperidin-4-yl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | L486-0064 |
| Compound Name: | 3-[1-(2,4,5-trimethylbenzene-1-sulfonyl)piperidin-4-yl]quinazolin-4(3H)-one |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C22 H25 N3 O3 S |
| Smiles: | Cc1cc(C)c(cc1C)S(N1CCC(CC1)N1C=Nc2ccccc2C1=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5477 |
| logD: | 3.5477 |
| logSw: | -3.8044 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.245 |
| InChI Key: | GNKAGJIJJLWOTA-UHFFFAOYSA-N |