5-amino-N-(2-methoxy-5-methylphenyl)-1-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-(2-methoxy-5-methylphenyl)-1-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(2-methoxy-5-methylphenyl)-1-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | E919-2128 |
| Compound Name: | 5-amino-N-(2-methoxy-5-methylphenyl)-1-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 422.49 |
| Molecular Formula: | C22 H26 N6 O3 |
| Smiles: | CC(C)c1ccc(cc1)NC(Cn1c(c(C(Nc2cc(C)ccc2OC)=O)nn1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0621 |
| logD: | 3.062 |
| logSw: | -3.2416 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 99.369 |
| InChI Key: | PQPAXSYBAVCEKN-UHFFFAOYSA-N |