9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole

C22H20FNO4 — CID 134948888

IUPAC9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole
SMILESCOc1cc2c3cc(OC)c(OC)cc3n(-c3ccc(F)cc3)c2cc1OC
InChIInChI=1S/C22H20FNO4/c1-25-19-9-15-16-10-20(26-2)22(28-4)12-18(16)24(17(15)11-21(19)27-3)14-7-5-13(23)6-8-14/h5-12H,1-4H3
InChIKeyCDSKLSLABWLYKI-UHFFFAOYSA-N
MW381.40 g/mol
LogP4.96
Rot. Bonds5

About 9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole

9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole (PubChem CID 134948888) has the molecular formula C22H20FNO4 and a molecular weight of 381.40 g/mol. Its IUPAC name is 9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole.

Molecular Properties

Compound Name9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole
PubChem CID134948888
Molecular FormulaC22H20FNO4
Molecular Weight381.40 g/mol
Exact Mass381.14
IUPAC Name9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole
SMILESCOc1cc2c3cc(OC)c(OC)cc3n(-c3ccc(F)cc3)c2cc1OC
InChIInChI=1S/C22H20FNO4/c1-25-19-9-15-16-10-20(26-2)22(28-4)12-18(16)24(17(15)11-21(19)27-3)14-7-5-13(23)6-8-14/h5-12H,1-4H3
InChIKeyCDSKLSLABWLYKI-UHFFFAOYSA-N
XLogP4.96
TPSA41.85 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.40
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole?
The IUPAC name of 9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole (CID 134948888) is 9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole.
What is the SMILES notation for 9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole?
The canonical SMILES for 9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole is COc1cc2c3cc(OC)c(OC)cc3n(-c3ccc(F)cc3)c2cc1OC.
What is the InChIKey of 9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole?
The InChIKey is CDSKLSLABWLYKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FNO4/c1-25-19-9-15-16-10-20(26-2)22(28-4)12-18(16)24(17(15)11-21(19)27-3)14-7-5-13(23)6-8-14/h5-12H,1-4H3.
What are the key properties of 9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole?
9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole has a molecular weight of 381.40 g/mol, XLogP of 4.96, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-fluorophenyl)-2,3,6,7-tetramethoxycarbazole is sourced from PubChem (CID 134948888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).