(6S)-N-[2-(azepan-1-yl)-2-oxoethyl]-N-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxamide
Chemical Structure Depiction of
(6S)-N-[2-(azepan-1-yl)-2-oxoethyl]-N-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxamide
(6S)-N-[2-(azepan-1-yl)-2-oxoethyl]-N-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxamide
Compound characteristics
| Compound ID: | SD69-0366 |
| Compound Name: | (6S)-N-[2-(azepan-1-yl)-2-oxoethyl]-N-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxamide |
| Molecular Weight: | 410.47 |
| Molecular Formula: | C21 H26 N6 O3 |
| Smiles: | CN(CC(N1CCCCCC1)=O)C(c1c2C(N[C@H](Cn2nn1)c1ccccc1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.6298 |
| logD: | 0.6298 |
| logSw: | -1.7288 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.449 |
| InChI Key: | JYMFWCOAAWWRAX-MRXNPFEDSA-N |