N-[2-(azepan-1-yl)ethyl]-2-(3-cyclopentyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-2-(3-cyclopentyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide--hydrogen chloride (1/1)
N-[2-(azepan-1-yl)ethyl]-2-(3-cyclopentyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | CM4207-2188 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-2-(3-cyclopentyl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)acetamide--hydrogen chloride (1/1) |
| Molecular Weight: | 424.03 |
| Molecular Formula: | C22 H37 N5 O |
| Salt: | HCl |
| Smiles: | C1CCCN(CC1)CCNC(CC1CCc2nnc(C3CCCC3)n2CC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7204 |
| logD: | 1.0216 |
| logSw: | -2.8368 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.176 |
| InChI Key: | DQCVSBHYRXFGFG-SFHVURJKSA-N |