N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[2-hydroxy-2-(4-methylphenyl)ethyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[2-hydroxy-2-(4-methylphenyl)ethyl]-1H-1,2,3-triazole-4-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[2-hydroxy-2-(4-methylphenyl)ethyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | P783-0088 |
Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[2-hydroxy-2-(4-methylphenyl)ethyl]-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 380.4 |
Molecular Formula: | C20 H20 N4 O4 |
Smiles: | Cc1ccc(cc1)C(Cn1cc(C(Nc2ccc3c(c2)OCCO3)=O)nn1)O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.4175 |
logD: | 1.4165 |
logSw: | -2.1499 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 81.818 |
InChI Key: | IGJAGVQOUYEDBO-KRWDZBQOSA-N |