2-fluoro-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
2-fluoro-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)benzene-1-sulfonamide
2-fluoro-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | S637-0296 |
| Compound Name: | 2-fluoro-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)benzene-1-sulfonamide |
| Molecular Weight: | 324.37 |
| Molecular Formula: | C14 H17 F N4 O2 S |
| Smiles: | Cc1nnc2CCC(CCn12)NS(c1ccccc1F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8917 |
| logD: | 0.8907 |
| logSw: | -2.204 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.816 |
| InChI Key: | ZDZKJORUUBHZSH-NSHDSACASA-N |