N-(4-bromo-2-fluorophenyl)-2-[(8,9-dimethoxy-2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-2-[(8,9-dimethoxy-2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetamide
N-(4-bromo-2-fluorophenyl)-2-[(8,9-dimethoxy-2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C445-0067 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-2-[(8,9-dimethoxy-2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 506.35 |
| Molecular Formula: | C20 H17 Br F N5 O3 S |
| Smiles: | Cc1nc2c3cc(c(cc3nc(n2n1)SCC(Nc1ccc(cc1F)[Br])=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.5812 |
| logD: | 3.555 |
| logSw: | -3.8826 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.394 |
| InChI Key: | LACVXFSQJYAPGK-UHFFFAOYSA-N |