2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]quinazolin-4(3H)-one
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-2156 |
| Compound Name: | 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]quinazolin-4(3H)-one |
| Molecular Weight: | 478.95 |
| Molecular Formula: | C25 H19 Cl N2 O4 S |
| Smiles: | C(C1COc2ccccc2O1)N1C(=Nc2ccccc2C1=O)SCC(c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5447 |
| logD: | 4.5447 |
| logSw: | -4.8655 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.697 |
| InChI Key: | FNHQMUCTKQPOGR-SFHVURJKSA-N |