N-(4-{3-[4-(5-tert-butyl-1H-1,2,3-triazol-1-yl)phenyl]-3-oxoprop-1-en-1-yl}phenyl)acetamide
Chemical Structure Depiction of
N-(4-{3-[4-(5-tert-butyl-1H-1,2,3-triazol-1-yl)phenyl]-3-oxoprop-1-en-1-yl}phenyl)acetamide
N-(4-{3-[4-(5-tert-butyl-1H-1,2,3-triazol-1-yl)phenyl]-3-oxoprop-1-en-1-yl}phenyl)acetamide
Compound characteristics
| Compound ID: | K415-0377 |
| Compound Name: | N-(4-{3-[4-(5-tert-butyl-1H-1,2,3-triazol-1-yl)phenyl]-3-oxoprop-1-en-1-yl}phenyl)acetamide |
| Molecular Weight: | 388.47 |
| Molecular Formula: | C23 H24 N4 O2 |
| Smiles: | CC(Nc1ccc(/C=C/C(c2ccc(cc2)n2c(cnn2)C(C)(C)C)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9106 |
| logD: | 3.9104 |
| logSw: | -4.004 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.732 |
| InChI Key: | HKVHKUCOUKYWEO-UHFFFAOYSA-N |