3-[1-(2,4-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-6-fluoroquinazolin-4(3H)-one
Chemical Structure Depiction of
3-[1-(2,4-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-6-fluoroquinazolin-4(3H)-one
3-[1-(2,4-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-6-fluoroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | L486-0300 |
| Compound Name: | 3-[1-(2,4-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-6-fluoroquinazolin-4(3H)-one |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C21 H22 F N3 O3 S |
| Smiles: | Cc1ccc(c(C)c1)S(N1CCC(CC1)N1C=Nc2ccc(cc2C1=O)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5105 |
| logD: | 3.5105 |
| logSw: | -3.7385 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.245 |
| InChI Key: | MXJYWXJELQJBAJ-UHFFFAOYSA-N |