[5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole

C97H82ClFN10O9S — CID 159757805

IUPAC[5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole
SMILESCOCc1ccc(-c2nn(Cc3ccccc3)c3ccccc23)o1.COc1ccc2c(-c3ccc(CO)o3)nn(Cc3ccccc3)c2c1.Cc1ccc(-c2nn(Cc3ccc(Cl)cc3)c3ccccc23)cc1.OCc1ccc(-c2nn(Cc3ccccc3)c3cc(F)ccc23)o1.OCc1ccc(-c2nn(Cc3ccccc3)c3ccsc23)o1
InChIInChI=1S/C21H17ClN2.C20H18N2O3.C20H18N2O2.C19H15FN2O2.C17H14N2O2S/c1-15-6-10-17(11-7-15)21-19-4-2-3-5-20(19)24(23-21)14-16-8-12-18(22)13-9-16;1-24-15-7-9-17-18(11-15)22(12-14-5-3-2-4-6-14)21-20(17)19-10-8-16(13-23)25-19;1-23-14-16-11-12-19(24-16)20-17-9-5-6-10-18(17)22(21-20)13-15-7-3-2-4-8-15;20-14-6-8-16-17(10-14)22(11-13-4-2-1-3-5-13)21-19(16)18-9-7-15(12-23)24-18;20-11-13-6-7-15(21-13)16-17-14(8-9-22-17)19(18-16)10-12-4-2-1-3-5-12/h2-13H,14H2,1H3;2-11,23H,12-13H2,1H3;2-12H,13-14H2,1H3;1-10,23H,11-12H2;1-9,20H,10-11H2
InChIKeyNEMJCSLCFWFJQM-UHFFFAOYSA-N
MW1618.30 g/mol
LogP21.92
Rot. Bonds21

About [5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole

[5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole (PubChem CID 159757805) has the molecular formula C97H82ClFN10O9S and a molecular weight of 1618.30 g/mol. Its IUPAC name is [5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole.

Molecular Properties

Compound Name[5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole
PubChem CID159757805
Molecular FormulaC97H82ClFN10O9S
Molecular Weight1618.30 g/mol
Exact Mass1616.57
IUPAC Name[5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole
SMILESCOCc1ccc(-c2nn(Cc3ccccc3)c3ccccc23)o1.COc1ccc2c(-c3ccc(CO)o3)nn(Cc3ccccc3)c2c1.Cc1ccc(-c2nn(Cc3ccc(Cl)cc3)c3ccccc23)cc1.OCc1ccc(-c2nn(Cc3ccccc3)c3cc(F)ccc23)o1.OCc1ccc(-c2nn(Cc3ccccc3)c3ccsc23)o1
InChIInChI=1S/C21H17ClN2.C20H18N2O3.C20H18N2O2.C19H15FN2O2.C17H14N2O2S/c1-15-6-10-17(11-7-15)21-19-4-2-3-5-20(19)24(23-21)14-16-8-12-18(22)13-9-16;1-24-15-7-9-17-18(11-15)22(12-14-5-3-2-4-6-14)21-20(17)19-10-8-16(13-23)25-19;1-23-14-16-11-12-19(24-16)20-17-9-5-6-10-18(17)22(21-20)13-15-7-3-2-4-8-15;20-14-6-8-16-17(10-14)22(11-13-4-2-1-3-5-13)21-19(16)18-9-7-15(12-23)24-18;20-11-13-6-7-15(21-13)16-17-14(8-9-22-17)19(18-16)10-12-4-2-1-3-5-12/h2-13H,14H2,1H3;2-11,23H,12-13H2,1H3;2-12H,13-14H2,1H3;1-10,23H,11-12H2;1-9,20H,10-11H2
InChIKeyNEMJCSLCFWFJQM-UHFFFAOYSA-N
XLogP21.92
TPSA220.81 Ų
H-Bond Donors3
H-Bond Acceptors20
Rotatable Bonds21
Heavy Atoms119
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001618.30
LogP ≤ 521.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1020

Analyze [5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of [5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole?
The IUPAC name of [5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole (CID 159757805) is [5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole.
What is the SMILES notation for [5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole?
The canonical SMILES for [5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole is COCc1ccc(-c2nn(Cc3ccccc3)c3ccccc23)o1.COc1ccc2c(-c3ccc(CO)o3)nn(Cc3ccccc3)c2c1.Cc1ccc(-c2nn(Cc3ccc(Cl)cc3)c3ccccc23)cc1.OCc1ccc(-c2nn(Cc3ccccc3)c3cc(F)ccc23)o1.OCc1ccc(-c2nn(Cc3ccccc3)c3ccsc23)o1.
What is the InChIKey of [5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole?
The InChIKey is NEMJCSLCFWFJQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClN2.C20H18N2O3.C20H18N2O2.C19H15FN2O2.C17H14N2O2S/c1-15-6-10-17(11-7-15)21-19-4-2-3-5-20(19)24(23-21)14-16-8-12-18(22)13-9-16;1-24-15-7-9-17-18(11-15)22(12-14-5-3-2-4-6-14)21-20(17)19-10-8-16(13-23)25-19;1-23-14-16-11-12-19(24-16)20-17-9-5-6-10-18(17)22(21-20)13-15-7-3-2-4-8-15;20-14-6-8-16-17(10-14)22(11-13-4-2-1-3-5-13)21-19(16)18-9-7-15(12-23)24-18;20-11-13-6-7-15(21-13)16-17-14(8-9-22-17)19(18-16)10-12-4-2-1-3-5-12/h2-13H,14H2,1H3;2-11,23H,12-13H2,1H3;2-12H,13-14H2,1H3;1-10,23H,11-12H2;1-9,20H,10-11H2.
What are the key properties of [5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole?
[5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole has a molecular weight of 1618.30 g/mol, XLogP of 21.92, 21 rotatable bonds, 3 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1-benzyl-6-fluoroindazol-3-yl)furan-2-yl]methanol;[5-(1-benzyl-6-methoxyindazol-3-yl)furan-2-yl]methanol;1-benzyl-3-[5-(methoxymethyl)furan-2-yl]indazole;[5-(1-benzylthieno[3,2-c]pyrazol-3-yl)furan-2-yl]methanol;1-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)indazole is sourced from PubChem (CID 159757805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).