5-amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1H-1,2,3-triazole-4-carboxamide
5-amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C368-0772 |
| Compound Name: | 5-amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 480.57 |
| Molecular Formula: | C25 H32 N6 O4 |
| Smiles: | CCOc1ccc(CCNC(c2c(N)n(CC(NCc3ccc(C)cc3)=O)nn2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 1.223 |
| logD: | 1.223 |
| logSw: | -2.2777 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 109.343 |
| InChI Key: | LKLPNQIOQBMHBM-UHFFFAOYSA-N |