4-(1H-indol-3-yl)-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)butanamide
Chemical Structure Depiction of
4-(1H-indol-3-yl)-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)butanamide
4-(1H-indol-3-yl)-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)butanamide
Compound characteristics
| Compound ID: | S637-0052 |
| Compound Name: | 4-(1H-indol-3-yl)-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)butanamide |
| Molecular Weight: | 351.45 |
| Molecular Formula: | C20 H25 N5 O |
| Smiles: | Cc1nnc2CCC(CCn12)NC(CCCc1c[nH]c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5849 |
| logD: | 1.5824 |
| logSw: | -2.1071 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.915 |
| InChI Key: | LGKFIMWJKNNWPZ-INIZCTEOSA-N |