1',3',5'-trimethyl-N-[(oxan-4-yl)methyl]-1'H,2H-[3,4'-bipyrazole]-5-carboxamide
Chemical Structure Depiction of
1',3',5'-trimethyl-N-[(oxan-4-yl)methyl]-1'H,2H-[3,4'-bipyrazole]-5-carboxamide
1',3',5'-trimethyl-N-[(oxan-4-yl)methyl]-1'H,2H-[3,4'-bipyrazole]-5-carboxamide
Compound characteristics
| Compound ID: | Y041-3197 |
| Compound Name: | 1',3',5'-trimethyl-N-[(oxan-4-yl)methyl]-1'H,2H-[3,4'-bipyrazole]-5-carboxamide |
| Molecular Weight: | 317.39 |
| Molecular Formula: | C16 H23 N5 O2 |
| Smiles: | Cc1c(c2cc(C(NCC3CCOCC3)=O)n[nH]2)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.7201 |
| logD: | 0.72 |
| logSw: | -1.6503 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.082 |
| InChI Key: | CTLMTIJQLUSHMT-UHFFFAOYSA-N |