2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6,7,8-trimethoxy-3-(4-methylphenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6,7,8-trimethoxy-3-(4-methylphenyl)quinazolin-4(3H)-one
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6,7,8-trimethoxy-3-(4-methylphenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | V008-1142 |
| Compound Name: | 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6,7,8-trimethoxy-3-(4-methylphenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 511 |
| Molecular Formula: | C26 H23 Cl N2 O5 S |
| Smiles: | Cc1ccc(cc1)N1C(=Nc2c(cc(c(c2OC)OC)OC)C1=O)SCC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2002 |
| logD: | 5.1998 |
| logSw: | -5.5466 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.219 |
| InChI Key: | XXIBXSPLMPDJQH-UHFFFAOYSA-N |