[2-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone
Chemical Structure Depiction of
[2-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone
[2-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone
Compound characteristics
Compound ID: | V026-5525 |
Compound Name: | [2-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone |
Molecular Weight: | 488.58 |
Molecular Formula: | C27 H25 F N4 O2 S |
Salt: | not_available |
Smiles: | C(c1ccccc1)c1nnc(n1c1ccc(cc1)F)SCc1ccccc1C(N1CCOCC1)=O |
Stereo: | ACHIRAL |
logP: | 4.1627 |
logD: | 4.1627 |
logSw: | -4.3947 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 50.245 |
InChI Key: | PCLRNURMFZJRQR-UHFFFAOYSA-N |