2-(2-fluorophenyl)-N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide
Chemical Structure Depiction of
2-(2-fluorophenyl)-N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide
2-(2-fluorophenyl)-N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide
Compound characteristics
| Compound ID: | S637-3126 |
| Compound Name: | 2-(2-fluorophenyl)-N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide |
| Molecular Weight: | 316.38 |
| Molecular Formula: | C17 H21 F N4 O |
| Smiles: | Cc1nnc2CCC(CCn12)N(C)C(Cc1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.408 |
| logD: | 1.4055 |
| logSw: | -1.7598 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.794 |
| InChI Key: | QQZCEYLSWPAKQS-AWEZNQCLSA-N |