8-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
Chemical Structure Depiction of
8-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
8-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
Compound characteristics
| Compound ID: | E514-0577 |
| Compound Name: | 8-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine |
| Molecular Weight: | 361.82 |
| Molecular Formula: | C17 H13 Cl F N3 O S |
| Smiles: | Cc1nnc(c2cc3c(cc(C)o3)n12)SCc1c(cccc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 4.3828 |
| logD: | 4.3823 |
| logSw: | -4.5109 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.082 |
| InChI Key: | XGHCPYSZWOLISJ-UHFFFAOYSA-N |