[5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol

C19H14F2N2O2 — CID 90666918

IUPAC[5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol
SMILESOCc1ccc(-c2nn(Cc3ccc(F)cc3F)c3ccccc23)o1
InChIInChI=1S/C19H14F2N2O2/c20-13-6-5-12(16(21)9-13)10-23-17-4-2-1-3-15(17)19(22-23)18-8-7-14(11-24)25-18/h1-9,24H,10-11H2
InChIKeyAUUKIMXJYJBMIS-UHFFFAOYSA-N
MW340.33 g/mol
LogP4.12
Rot. Bonds4

About [5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol

[5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol (PubChem CID 90666918) has the molecular formula C19H14F2N2O2 and a molecular weight of 340.33 g/mol. Its IUPAC name is [5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol.

Molecular Properties

Compound Name[5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol
PubChem CID90666918
Molecular FormulaC19H14F2N2O2
Molecular Weight340.33 g/mol
Exact Mass340.10
IUPAC Name[5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol
SMILESOCc1ccc(-c2nn(Cc3ccc(F)cc3F)c3ccccc23)o1
InChIInChI=1S/C19H14F2N2O2/c20-13-6-5-12(16(21)9-13)10-23-17-4-2-1-3-15(17)19(22-23)18-8-7-14(11-24)25-18/h1-9,24H,10-11H2
InChIKeyAUUKIMXJYJBMIS-UHFFFAOYSA-N
XLogP4.12
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.33
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol?
The IUPAC name of [5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol (CID 90666918) is [5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol.
What is the SMILES notation for [5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol?
The canonical SMILES for [5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol is OCc1ccc(-c2nn(Cc3ccc(F)cc3F)c3ccccc23)o1.
What is the InChIKey of [5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol?
The InChIKey is AUUKIMXJYJBMIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F2N2O2/c20-13-6-5-12(16(21)9-13)10-23-17-4-2-1-3-15(17)19(22-23)18-8-7-14(11-24)25-18/h1-9,24H,10-11H2.
What are the key properties of [5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol?
[5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol has a molecular weight of 340.33 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol is sourced from PubChem (CID 90666918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).