2-(4-chlorophenyl)-6-hexyl-7-hydroxy[1]benzopyrano[2,3-c]pyrazol-3(2H)-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-6-hexyl-7-hydroxy[1]benzopyrano[2,3-c]pyrazol-3(2H)-one
2-(4-chlorophenyl)-6-hexyl-7-hydroxy[1]benzopyrano[2,3-c]pyrazol-3(2H)-one
Compound characteristics
| Compound ID: | F808-0937 |
| Compound Name: | 2-(4-chlorophenyl)-6-hexyl-7-hydroxy[1]benzopyrano[2,3-c]pyrazol-3(2H)-one |
| Molecular Weight: | 396.87 |
| Molecular Formula: | C22 H21 Cl N2 O3 |
| Smiles: | CCCCCCc1cc2C=C3C(=NN(C3=O)c3ccc(cc3)[Cl])Oc2cc1O |
| Stereo: | ACHIRAL |
| logP: | 5.6562 |
| logD: | 5.6544 |
| logSw: | -5.4638 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.133 |
| InChI Key: | UDIWPDPVNRIDMW-UHFFFAOYSA-N |