ethyl 1-{4-amino-6-[di(propan-2-yl)amino]-1,3,5-triazin-2-yl}-5-phenyl-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-amino-6-[di(propan-2-yl)amino]-1,3,5-triazin-2-yl}-5-phenyl-1H-1,2,3-triazole-4-carboxylate
ethyl 1-{4-amino-6-[di(propan-2-yl)amino]-1,3,5-triazin-2-yl}-5-phenyl-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8016-5839 |
| Compound Name: | ethyl 1-{4-amino-6-[di(propan-2-yl)amino]-1,3,5-triazin-2-yl}-5-phenyl-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 410.48 |
| Molecular Formula: | C20 H26 N8 O2 |
| Smiles: | CCOC(c1c(c2ccccc2)n(c2nc(N)nc(n2)N(C(C)C)C(C)C)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4799 |
| logD: | 3.4798 |
| logSw: | -3.4779 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.662 |
| InChI Key: | DDPFFKLHHVWSIG-UHFFFAOYSA-N |