1-(3,4-dichlorophenyl)-2-{[4-(3,4,5-trimethoxyanilino)quinazolin-2-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(3,4-dichlorophenyl)-2-{[4-(3,4,5-trimethoxyanilino)quinazolin-2-yl]sulfanyl}ethan-1-one
1-(3,4-dichlorophenyl)-2-{[4-(3,4,5-trimethoxyanilino)quinazolin-2-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | K297-0622 |
| Compound Name: | 1-(3,4-dichlorophenyl)-2-{[4-(3,4,5-trimethoxyanilino)quinazolin-2-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 530.43 |
| Molecular Formula: | C25 H21 Cl2 N3 O4 S |
| Smiles: | COc1cc(cc(c1OC)OC)Nc1c2ccccc2nc(n1)SCC(c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.4557 |
| logD: | 6.4557 |
| logSw: | -6.3124 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.752 |
| InChI Key: | AZSLLOSXXBJMNO-UHFFFAOYSA-N |