3-[1-(3-chloro-4-methylbenzene-1-sulfonyl)piperidin-4-yl]-6-methylquinazolin-4(3H)-one
Chemical Structure Depiction of
3-[1-(3-chloro-4-methylbenzene-1-sulfonyl)piperidin-4-yl]-6-methylquinazolin-4(3H)-one
3-[1-(3-chloro-4-methylbenzene-1-sulfonyl)piperidin-4-yl]-6-methylquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | L486-1224 |
| Compound Name: | 3-[1-(3-chloro-4-methylbenzene-1-sulfonyl)piperidin-4-yl]-6-methylquinazolin-4(3H)-one |
| Molecular Weight: | 431.94 |
| Molecular Formula: | C21 H22 Cl N3 O3 S |
| Smiles: | Cc1ccc2c(c1)C(N(C=N2)C1CCN(CC1)S(c1ccc(C)c(c1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0048 |
| logD: | 4.0048 |
| logSw: | -4.3714 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.245 |
| InChI Key: | ZLQUPPDQLVWTPY-UHFFFAOYSA-N |