2-(cyclopropylmethyl)-7-[2-(trifluoromethyl)benzene-1-sulfonyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
2-(cyclopropylmethyl)-7-[2-(trifluoromethyl)benzene-1-sulfonyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
2-(cyclopropylmethyl)-7-[2-(trifluoromethyl)benzene-1-sulfonyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | CM4439-1882 |
| Compound Name: | 2-(cyclopropylmethyl)-7-[2-(trifluoromethyl)benzene-1-sulfonyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 402.39 |
| Molecular Formula: | C16 H17 F3 N4 O3 S |
| Smiles: | C1CC1CN1C(N2CCN(CC2=N1)S(c1ccccc1C(F)(F)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.694 |
| logD: | 2.694 |
| logSw: | -3.2827 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.16 |
| InChI Key: | WVZCHGOVCWTQEL-UHFFFAOYSA-N |