N-[(furan-2-yl)methyl]-5-methyl-1-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-5-methyl-1-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
N-[(furan-2-yl)methyl]-5-methyl-1-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | G684-0728 |
Compound Name: | N-[(furan-2-yl)methyl]-5-methyl-1-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 391.43 |
Molecular Formula: | C21 H21 N5 O3 |
Smiles: | Cc1ccc(cc1)c1nc(Cn2c(C)c(C(NCc3ccco3)=O)nn2)c(C)o1 |
Stereo: | ACHIRAL |
logP: | 3.1074 |
logD: | 3.1073 |
logSw: | -3.2033 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 77.229 |
InChI Key: | JZHBRZPEZYOPFH-UHFFFAOYSA-N |