N-[(5-benzyl-7-methyl-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-7-methyl-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-7-methyl-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: | SC45-1027 |
| Compound Name: | N-[(5-benzyl-7-methyl-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: | 465.57 |
| Molecular Formula: | C24 H27 N5 O3 S |
| Smiles: | CC1C(N(Cc2ccccc2)Cc2c(CNS(c3ccc4CCCCc4c3)(=O)=O)nnn12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9492 |
| logD: | 2.9209 |
| logSw: | -3.5409 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.622 |
| InChI Key: | BFLIZZPYSDMLAY-KRWDZBQOSA-N |