6-tert-butyl-2-(2,4-dimethylphenyl)-8-hydroxy[1]benzopyrano[2,3-c]pyrazol-3(2H)-one
Chemical Structure Depiction of
6-tert-butyl-2-(2,4-dimethylphenyl)-8-hydroxy[1]benzopyrano[2,3-c]pyrazol-3(2H)-one
6-tert-butyl-2-(2,4-dimethylphenyl)-8-hydroxy[1]benzopyrano[2,3-c]pyrazol-3(2H)-one
Compound characteristics
| Compound ID: | F808-0580 |
| Compound Name: | 6-tert-butyl-2-(2,4-dimethylphenyl)-8-hydroxy[1]benzopyrano[2,3-c]pyrazol-3(2H)-one |
| Molecular Weight: | 362.43 |
| Molecular Formula: | C22 H22 N2 O3 |
| Smiles: | Cc1ccc(c(C)c1)N1C(C2=Cc3cc(cc(c3OC2=N1)O)C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3792 |
| logD: | 5.3774 |
| logSw: | -5.264 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.517 |
| InChI Key: | AKXRYJPHAPYGDC-UHFFFAOYSA-N |