2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-benzylquinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-benzylquinazolin-4(3H)-one
2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-benzylquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-0775 |
| Compound Name: | 2-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-benzylquinazolin-4(3H)-one |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C25 H22 N2 O3 S |
| Smiles: | CC(c1ccc(c(CSC2=Nc3ccccc3C(N2Cc2ccccc2)=O)c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.448 |
| logD: | 4.448 |
| logSw: | -4.4346 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.228 |
| InChI Key: | JGHDEWRCGRBCGP-UHFFFAOYSA-N |