N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-2-(thiophen-2-yl)acetamide
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)-2-(thiophen-2-yl)acetamide
N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-2-(thiophen-2-yl)acetamide
Compound characteristics
| Compound ID: | S637-3103 |
| Compound Name: | N-methyl-N-(3-methyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)-2-(thiophen-2-yl)acetamide |
| Molecular Weight: | 304.41 |
| Molecular Formula: | C15 H20 N4 O S |
| Smiles: | Cc1nnc2CCC(CCn12)N(C)C(Cc1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7256 |
| logD: | 0.723 |
| logSw: | -1.8225 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.812 |
| InChI Key: | HIRKYRRAOLEUIQ-LBPRGKRZSA-N |