1-(4-chlorophenyl)-2-{[4-(3,4-difluoroanilino)quinazolin-2-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(4-chlorophenyl)-2-{[4-(3,4-difluoroanilino)quinazolin-2-yl]sulfanyl}ethan-1-one
1-(4-chlorophenyl)-2-{[4-(3,4-difluoroanilino)quinazolin-2-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | K297-0857 |
| Compound Name: | 1-(4-chlorophenyl)-2-{[4-(3,4-difluoroanilino)quinazolin-2-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 441.89 |
| Molecular Formula: | C22 H14 Cl F2 N3 O S |
| Smiles: | C(C(c1ccc(cc1)[Cl])=O)Sc1nc(c2ccccc2n1)Nc1ccc(c(c1)F)F |
| Stereo: | ACHIRAL |
| logP: | 6.5073 |
| logD: | 6.5073 |
| logSw: | -6.544 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.774 |
| InChI Key: | LCSPNRJJXAPGNJ-UHFFFAOYSA-N |