1-(4-chlorobenzene-1-sulfonyl)-N-{[6-oxo-7-(propan-2-yl)-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl]methyl}cyclopropane-1-carboxamide
Chemical Structure Depiction of
1-(4-chlorobenzene-1-sulfonyl)-N-{[6-oxo-7-(propan-2-yl)-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl]methyl}cyclopropane-1-carboxamide
1-(4-chlorobenzene-1-sulfonyl)-N-{[6-oxo-7-(propan-2-yl)-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl]methyl}cyclopropane-1-carboxamide
Compound characteristics
| Compound ID: | SC45-0789 |
| Compound Name: | 1-(4-chlorobenzene-1-sulfonyl)-N-{[6-oxo-7-(propan-2-yl)-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl]methyl}cyclopropane-1-carboxamide |
| Molecular Weight: | 451.93 |
| Molecular Formula: | C19 H22 Cl N5 O4 S |
| Smiles: | CC(C)C1C(NCc2c(CNC(C3(CC3)S(c3ccc(cc3)[Cl])(=O)=O)=O)nnn12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1001 |
| logD: | 1.1001 |
| logSw: | -2.7734 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.441 |
| InChI Key: | TTXOMBWNIGYQMI-INIZCTEOSA-N |