N-({4-methoxy-3-[(2-methyl-1H-imidazol-1-yl)methyl]phenyl}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-({4-methoxy-3-[(2-methyl-1H-imidazol-1-yl)methyl]phenyl}methyl)-N,3-dimethyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-amine
N-({4-methoxy-3-[(2-methyl-1H-imidazol-1-yl)methyl]phenyl}methyl)-N,3-dimethyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-amine
Compound characteristics
| Compound ID: | S637-3332 |
| Compound Name: | N-({4-methoxy-3-[(2-methyl-1H-imidazol-1-yl)methyl]phenyl}methyl)-N,3-dimethyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-amine |
| Molecular Weight: | 394.52 |
| Molecular Formula: | C22 H30 N6 O |
| Smiles: | Cc1nccn1Cc1cc(CN(C)C2CCc3nnc(C)n3CC2)ccc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2232 |
| logD: | -0.5032 |
| logSw: | -1.9164 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.824 |
| InChI Key: | RFQCJOLGWCWSIB-FQEVSTJZSA-N |