5-amino-N-[(4-chlorophenyl)methyl]-1-{[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-[(4-chlorophenyl)methyl]-1-{[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
5-amino-N-[(4-chlorophenyl)methyl]-1-{[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L937-0037 |
| Compound Name: | 5-amino-N-[(4-chlorophenyl)methyl]-1-{[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 466.93 |
| Molecular Formula: | C23 H23 Cl N6 O3 |
| Smiles: | CCOc1ccc(cc1)c1nc(Cn2c(c(C(NCc3ccc(cc3)[Cl])=O)nn2)N)c(C)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.2007 |
| logD: | 3.2007 |
| logSw: | -3.6344 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.855 |
| InChI Key: | IEBNTRSKSHCFEK-UHFFFAOYSA-N |