BEWMTAWSVCJGFE-UHFFFAOYSA-N
C22H18N6 — CID 118660621
Data last refreshed: (MolForge compound catalog, from PubChem)
About BEWMTAWSVCJGFE-UHFFFAOYSA-N
BEWMTAWSVCJGFE-UHFFFAOYSA-N (PubChem CID 118660621) has the molecular formula C22H18N6 and a molecular weight of 366.43 g/mol. Its IUPAC name is 2-(2-methylpyrazol-3-yl)-8-[4-(1-methylpyrazol-4-yl)phenyl]-1,6-naphthyridine.
Molecular Properties
| Compound Name | BEWMTAWSVCJGFE-UHFFFAOYSA-N |
|---|---|
| PubChem CID | 118660621 |
| Molecular Formula | C22H18N6 |
| Molecular Weight | 366.43 g/mol |
| Exact Mass | 366.16 |
| IUPAC Name | 2-(2-methylpyrazol-3-yl)-8-[4-(1-methylpyrazol-4-yl)phenyl]-1,6-naphthyridine |
| SMILES | Cn1cc(-c2ccc(-c3cncc4ccc(-c5ccnn5C)nc34)cc2)cn1 |
| InChI | InChI=1S/C22H18N6/c1-27-14-18(12-25-27)15-3-5-16(6-4-15)19-13-23-11-17-7-8-20(26-22(17)19)21-9-10-24-28(21)2/h3-14H,1-2H3 |
| InChIKey | BEWMTAWSVCJGFE-UHFFFAOYSA-N |
| XLogP | 4.10 |
| TPSA | 61.42 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 28 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 366.43 |
| LogP ≤ 5 | 4.10 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |
Frequently Asked Questions
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Sources
- PubChem CID 118660621 — identifiers, structure, computed properties (public domain)
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