N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]propanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]propanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]propanamide
Compound characteristics
| Compound ID: | K284-3936 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]propanamide |
| Molecular Weight: | 590.7 |
| Molecular Formula: | C31 H34 N4 O6 S |
| Smiles: | CCOc1ccc(cc1)NC(CSC1=Nc2ccccc2C(N1CCC(NCCc1ccc(c(c1)OC)OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9689 |
| logD: | 2.9689 |
| logSw: | -3.6711 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.596 |
| InChI Key: | NNFGBAREBJESLH-UHFFFAOYSA-N |