N-[(5-benzyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
Chemical Structure Depiction of
N-[(5-benzyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
N-[(5-benzyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
Compound characteristics
| Compound ID: | SC45-0973 |
| Compound Name: | N-[(5-benzyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide |
| Molecular Weight: | 451.55 |
| Molecular Formula: | C23 H25 N5 O3 S |
| Smiles: | C1CCc2cc(ccc2C1)S(NCc1c2CN(Cc3ccccc3)C(Cn2nn1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4652 |
| logD: | 2.4368 |
| logSw: | -2.9542 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.491 |
| InChI Key: | FYPCBHVLKYIUGT-UHFFFAOYSA-N |