2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6,7,8-trimethoxy-3-phenylquinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6,7,8-trimethoxy-3-phenylquinazolin-4(3H)-one
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6,7,8-trimethoxy-3-phenylquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | V019-8761 |
| Compound Name: | 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6,7,8-trimethoxy-3-phenylquinazolin-4(3H)-one |
| Molecular Weight: | 496.97 |
| Molecular Formula: | C25 H21 Cl N2 O5 S |
| Smiles: | COc1cc2C(N(C(=Nc2c(c1OC)OC)SCC(c1ccc(cc1)[Cl])=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6553 |
| logD: | 4.6549 |
| logSw: | -4.9033 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.219 |
| InChI Key: | XAMANUMHDBIGIM-UHFFFAOYSA-N |