N-(4-fluorophenyl)-2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-N-methylacetamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-N-methylacetamide
N-(4-fluorophenyl)-2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-N-methylacetamide
Compound characteristics
| Compound ID: | J084-0386 |
| Compound Name: | N-(4-fluorophenyl)-2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-N-methylacetamide |
| Molecular Weight: | 473.53 |
| Molecular Formula: | C25 H20 F N5 O2 S |
| Smiles: | CN(C(CSc1nnc2c3ccccc3nc(c3ccc(cc3)OC)n12)=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 4.4349 |
| logD: | 4.4315 |
| logSw: | -4.3754 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.967 |
| InChI Key: | JDDRZXHMIACGKM-UHFFFAOYSA-N |