methyl 2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K284-2036 |
| Compound Name: | methyl 2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 483.93 |
| Molecular Formula: | C23 H18 Cl N3 O5 S |
| Smiles: | COC(c1ccc2C(N(Cc3ccco3)C(=Nc2c1)SCC(Nc1ccccc1[Cl])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7612 |
| logD: | 3.7612 |
| logSw: | -4.0865 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.145 |
| InChI Key: | CYNJCXNJLJSWKX-UHFFFAOYSA-N |