PLFSBUVZIYVXAH-GLEZIHRCSA-N
C18H16F4N2O3 — CID 134363865
Data last refreshed: (MolForge compound catalog, from PubChem)
About PLFSBUVZIYVXAH-GLEZIHRCSA-N
PLFSBUVZIYVXAH-GLEZIHRCSA-N (PubChem CID 134363865) has the molecular formula C18H16F4N2O3 and a molecular weight of 384.33 g/mol. Its IUPAC name is (2R,3R)-2-(difluoromethoxymethyl)-5-(2,4-difluorophenyl)-3-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide.
Molecular Properties
| Compound Name | PLFSBUVZIYVXAH-GLEZIHRCSA-N |
|---|---|
| PubChem CID | 134363865 |
| Molecular Formula | C18H16F4N2O3 |
| Molecular Weight | 384.33 g/mol |
| Exact Mass | 384.11 |
| IUPAC Name | (2R,3R)-2-(difluoromethoxymethyl)-5-(2,4-difluorophenyl)-3-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide |
| SMILES | C[C@@H]1Cc2c(-c3ccc(F)cc3F)cc(C(N)=O)nc2O[C@H]1COC(F)F |
| InChI | InChI=1S/C18H16F4N2O3/c1-8-4-12-11(10-3-2-9(19)5-13(10)20)6-14(16(23)25)24-17(12)27-15(8)7-26-18(21)22/h2-3,5-6,8,15,18H,4,7H2,1H3,(H2,23,25)/t8-,15+/m1/s1 |
| InChIKey | PLFSBUVZIYVXAH-GLEZIHRCSA-N |
| XLogP | 3.30 |
| TPSA | 74.44 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 27 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 384.33 |
| LogP ≤ 5 | 3.30 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Sources
- PubChem CID 134363865 — identifiers, structure, computed properties (public domain)
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