N-(3-chloro-4-fluorophenyl)-2-[(2-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-[(2-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
N-(3-chloro-4-fluorophenyl)-2-[(2-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E514-0250 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-[(2-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide |
| Molecular Weight: | 390.82 |
| Molecular Formula: | C17 H12 Cl F N4 O2 S |
| Smiles: | Cc1cc2c(cc3c(nncn23)SCC(Nc2ccc(c(c2)[Cl])F)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.614 |
| logD: | 3.6037 |
| logSw: | -3.8575 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.06 |
| InChI Key: | RVHBQWPJYCMLMH-UHFFFAOYSA-N |