N-[(2,4-difluorophenyl)methyl]-N,3-dimethyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-amine
Chemical Structure Depiction of
N-[(2,4-difluorophenyl)methyl]-N,3-dimethyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-amine
N-[(2,4-difluorophenyl)methyl]-N,3-dimethyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-amine
Compound characteristics
| Compound ID: | S637-3287 |
| Compound Name: | N-[(2,4-difluorophenyl)methyl]-N,3-dimethyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-amine |
| Molecular Weight: | 306.36 |
| Molecular Formula: | C16 H20 F2 N4 |
| Smiles: | Cc1nnc2CCC(CCn12)N(C)Cc1ccc(cc1F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.884 |
| logD: | 0.8931 |
| logSw: | -1.8788 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 28.9068 |
| InChI Key: | SLTMWXSFIOBBEJ-AWEZNQCLSA-N |