N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1H-benzimidazole-5-carboxamide
Chemical Structure Depiction of
N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1H-benzimidazole-5-carboxamide
N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1H-benzimidazole-5-carboxamide
Compound characteristics
| Compound ID: | S637-3183 |
| Compound Name: | N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-1H-benzimidazole-5-carboxamide |
| Molecular Weight: | 324.38 |
| Molecular Formula: | C17 H20 N6 O |
| Smiles: | Cc1nnc2CCC(CCn12)N(C)C(c1ccc2c(c1)nc[nH]2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.2626 |
| logD: | 0.2547 |
| logSw: | -1.8681 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.851 |
| InChI Key: | OLQAJRIWHUWHJB-ZDUSSCGKSA-N |