6-chloro-3-[1-(3,4-dimethylbenzene-1-sulfonyl)piperidin-4-yl]quinazolin-4(3H)-one
Chemical Structure Depiction of
6-chloro-3-[1-(3,4-dimethylbenzene-1-sulfonyl)piperidin-4-yl]quinazolin-4(3H)-one
6-chloro-3-[1-(3,4-dimethylbenzene-1-sulfonyl)piperidin-4-yl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | L486-0139 |
| Compound Name: | 6-chloro-3-[1-(3,4-dimethylbenzene-1-sulfonyl)piperidin-4-yl]quinazolin-4(3H)-one |
| Molecular Weight: | 431.94 |
| Molecular Formula: | C21 H22 Cl N3 O3 S |
| Smiles: | Cc1ccc(cc1C)S(N1CCC(CC1)N1C=Nc2ccc(cc2C1=O)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1481 |
| logD: | 4.1481 |
| logSw: | -4.4792 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.245 |
| InChI Key: | DRVVNIPOTBXSRD-UHFFFAOYSA-N |