5-amino-N-[(4-chlorophenyl)methyl]-1-{[2-(2-methoxyphenyl)-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-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
5-amino-N-[(4-chlorophenyl)methyl]-1-{[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L937-0044 |
| Compound Name: | 5-amino-N-[(4-chlorophenyl)methyl]-1-{[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 452.9 |
| Molecular Formula: | C22 H21 Cl N6 O3 |
| Smiles: | Cc1c(Cn2c(c(C(NCc3ccc(cc3)[Cl])=O)nn2)N)nc(c2ccccc2OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.5572 |
| logD: | 2.5572 |
| logSw: | -3.4713 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 96.362 |
| InChI Key: | QDYFDUIMDHTUNT-UHFFFAOYSA-N |