N-benzyl-1-[(4-fluorophenyl)methyl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-benzyl-1-[(4-fluorophenyl)methyl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide
N-benzyl-1-[(4-fluorophenyl)methyl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | S397-0871 |
| Compound Name: | N-benzyl-1-[(4-fluorophenyl)methyl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 365.41 |
| Molecular Formula: | C21 H20 F N3 O2 |
| Smiles: | C1COCc2c(C(NCc3ccccc3)=O)nn(Cc3ccc(cc3)F)c12 |
| Stereo: | ACHIRAL |
| logP: | 2.4788 |
| logD: | 2.4788 |
| logSw: | -2.6186 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.439 |
| InChI Key: | PXELZBVNHYPBSY-UHFFFAOYSA-N |