2-{[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-{[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
2-{[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | K297-0898 |
| Compound Name: | 2-{[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl}-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 534.63 |
| Molecular Formula: | C28 H30 N4 O5 S |
| Smiles: | COc1cc(cc(c1)OC)Nc1c2ccccc2nc(n1)SCC(NCCc1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5409 |
| logD: | 4.5408 |
| logSw: | -4.389 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.189 |
| InChI Key: | IPKDEFHHXCPCSB-UHFFFAOYSA-N |