ethyl 4-{[3-(3,4-dimethoxyphenyl)-7-{[(furan-2-yl)methyl]carbamoyl}-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-3-oxobutanoate
Chemical Structure Depiction of
ethyl 4-{[3-(3,4-dimethoxyphenyl)-7-{[(furan-2-yl)methyl]carbamoyl}-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-3-oxobutanoate
ethyl 4-{[3-(3,4-dimethoxyphenyl)-7-{[(furan-2-yl)methyl]carbamoyl}-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-3-oxobutanoate
Compound characteristics
| Compound ID: | K289-0528 |
| Compound Name: | ethyl 4-{[3-(3,4-dimethoxyphenyl)-7-{[(furan-2-yl)methyl]carbamoyl}-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-3-oxobutanoate |
| Molecular Weight: | 565.6 |
| Molecular Formula: | C28 H27 N3 O8 S |
| Smiles: | CCOC(CC(CSC1=Nc2cc(ccc2C(N1c1ccc(c(c1)OC)OC)=O)C(NCc1ccco1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5988 |
| logD: | 2.5988 |
| logSw: | -3.1897 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.768 |
| InChI Key: | GSOMPSVANHIVNO-UHFFFAOYSA-N |