5-amino-N-[(4-methoxyphenyl)methyl]-1-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-[(4-methoxyphenyl)methyl]-1-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-1H-1,2,3-triazole-4-carboxamide
5-amino-N-[(4-methoxyphenyl)methyl]-1-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C368-0505 |
| Compound Name: | 5-amino-N-[(4-methoxyphenyl)methyl]-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(NCc2ccc(cc2)OC)=O)nn1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6006 |
| logD: | 2.6006 |
| logSw: | -3.1161 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 101.303 |
| InChI Key: | QVBJDCIJFKNZCN-UHFFFAOYSA-N |