N-benzyl-2-{[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-benzyl-2-{[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl}acetamide
N-benzyl-2-{[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | K297-0895 |
| Compound Name: | N-benzyl-2-{[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C25 H24 N4 O3 S |
| Smiles: | COc1cc(cc(c1)OC)Nc1c2ccccc2nc(n1)SCC(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2492 |
| logD: | 5.249 |
| logSw: | -5.328 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.086 |
| InChI Key: | GYPSBGHMOCWGIV-UHFFFAOYSA-N |