N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1H-indole-6-carboxamide
Chemical Structure Depiction of
N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1H-indole-6-carboxamide
N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1H-indole-6-carboxamide
Compound characteristics
| Compound ID: | S637-0090 |
| Compound Name: | N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1H-indole-6-carboxamide |
| Molecular Weight: | 309.37 |
| Molecular Formula: | C17 H19 N5 O |
| Smiles: | Cc1nnc2CCC(CCn12)NC(c1ccc2cc[nH]c2c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3659 |
| logD: | 1.3634 |
| logSw: | -2.3975 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.039 |
| InChI Key: | KUXNPMGQNAJLRF-AWEZNQCLSA-N |