2-(cyclopropylmethyl)-7-[4-(trifluoromethoxy)benzoyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
2-(cyclopropylmethyl)-7-[4-(trifluoromethoxy)benzoyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
2-(cyclopropylmethyl)-7-[4-(trifluoromethoxy)benzoyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | S854-0301 |
| Compound Name: | 2-(cyclopropylmethyl)-7-[4-(trifluoromethoxy)benzoyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 382.34 |
| Molecular Formula: | C17 H17 F3 N4 O3 |
| Smiles: | C1CC1CN1C(N2CCN(CC2=N1)C(c1ccc(cc1)OC(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9469 |
| logD: | 2.9469 |
| logSw: | -3.2007 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.034 |
| InChI Key: | XXALCWUSINLORF-UHFFFAOYSA-N |