methyl 5-({[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-({[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)furan-2-carboxylate
methyl 5-({[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)furan-2-carboxylate
Compound characteristics
| Compound ID: | V006-1657 |
| Compound Name: | methyl 5-({[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)furan-2-carboxylate |
| Molecular Weight: | 426.88 |
| Molecular Formula: | C21 H15 Cl N2 O4 S |
| Smiles: | COC(c1ccc(CSC2=Nc3ccccc3C(N2c2ccc(cc2)[Cl])=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2284 |
| logD: | 4.2282 |
| logSw: | -4.6604 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.175 |
| InChI Key: | CXZOGHFAGHSKHU-UHFFFAOYSA-N |