2-(cyclohex-1-en-1-yl)-N-methyl-N-(2-methyl-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide
Chemical Structure Depiction of
2-(cyclohex-1-en-1-yl)-N-methyl-N-(2-methyl-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide
2-(cyclohex-1-en-1-yl)-N-methyl-N-(2-methyl-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide
Compound characteristics
| Compound ID: | S638-4829 |
| Compound Name: | 2-(cyclohex-1-en-1-yl)-N-methyl-N-(2-methyl-3-oxo-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide |
| Molecular Weight: | 318.42 |
| Molecular Formula: | C17 H26 N4 O2 |
| Smiles: | CN(C1CCC2=NN(C)C(N2CC1)=O)C(CC1CCCCC=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8589 |
| logD: | 1.8589 |
| logSw: | -1.7932 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.141 |
| InChI Key: | UFZBLNNTGDMOBN-CQSZACIVSA-N |