N-benzyl-3-[5-(4-fluorobenzoyl)-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl]propanamide
Chemical Structure Depiction of
N-benzyl-3-[5-(4-fluorobenzoyl)-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl]propanamide
N-benzyl-3-[5-(4-fluorobenzoyl)-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl]propanamide
Compound characteristics
Compound ID: | S586-0998 |
Compound Name: | N-benzyl-3-[5-(4-fluorobenzoyl)-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl]propanamide |
Molecular Weight: | 407.45 |
Molecular Formula: | C22 H22 F N5 O2 |
Smiles: | C(Cc1c2CN(CCn2nn1)C(c1ccc(cc1)F)=O)C(NCc1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 1.3509 |
logD: | 1.3509 |
logSw: | -2.0146 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.831 |
InChI Key: | NUUSXJYNWUHBMV-UHFFFAOYSA-N |