2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole

C30H20N4O — CID 140730409

IUPAC2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(Oc4cccc(-n5cc6ccccc6n5)c4)cc32)nc1
InChIInChI=1S/C30H20N4O/c1-3-12-27-21(8-1)20-33(32-27)22-9-7-10-23(18-22)35-24-15-16-26-25-11-2-4-13-28(25)34(29(26)19-24)30-14-5-6-17-31-30/h1-20H
InChIKeyDPVSWVRXJXWEMV-UHFFFAOYSA-N
MW452.52 g/mol
LogP7.31
Rot. Bonds4

About 2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole

2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole (PubChem CID 140730409) has the molecular formula C30H20N4O and a molecular weight of 452.52 g/mol. Its IUPAC name is 2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole.

Molecular Properties

Compound Name2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole
PubChem CID140730409
Molecular FormulaC30H20N4O
Molecular Weight452.52 g/mol
Exact Mass452.16
IUPAC Name2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(Oc4cccc(-n5cc6ccccc6n5)c4)cc32)nc1
InChIInChI=1S/C30H20N4O/c1-3-12-27-21(8-1)20-33(32-27)22-9-7-10-23(18-22)35-24-15-16-26-25-11-2-4-13-28(25)34(29(26)19-24)30-14-5-6-17-31-30/h1-20H
InChIKeyDPVSWVRXJXWEMV-UHFFFAOYSA-N
XLogP7.31
TPSA44.87 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.52
LogP ≤ 57.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[3-(9-pyridin-2-ylcarbazol-2-yl)oxyphenyl]selenopheno[3,2-c]pyrazole
CID 140731336
2-(3-pyrazol-1-ylphenoxy)-9-pyridin-2-ylcarbazole
CID 140794986
2-[3-(4-phenyltriazol-1-yl)phenoxy]-9-pyridin-2-ylcarbazole
CID 170654817
9-pyridin-2-yl-2-(3-quinolin-2-ylphenoxy)carbazole
CID 161376299
2-[3-(3-phenyl-2H-imidazol-1-yl)phenoxy]-9-pyridin-2-ylcarbazole
CID 160515373
5-[3-(9-pyridin-2-ylcarbazol-2-yl)oxyphenyl]benzimidazolo[1,2-c]quinazolin-7-ium
CID 162772046
3-[3-(1-methylbenzimidazol-2-yl)phenoxy]-11-phenyl-5-pyridin-2-ylindolo[3,2-b]carbazole
CID 140954841
4-(9-pyridin-2-ylcarbazol-2-yl)oxy-9,12,14,21-tetrazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaene
CID 140949999
10-[1-[3-(9-pyridin-2-ylcarbazol-2-yl)oxyphenyl]pyrazol-4-yl]phenoxazine
CID 140730449
5-(9-pyridin-2-ylcarbazol-2-yl)oxy-9,14,21-triazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8(13),9,11,15,17,19-decaene
CID 140950178
2-[3-(3,5-dimethyl-4-pyridin-2-ylpyrazol-1-yl)phenoxy]-9-pyridin-2-ylcarbazole
CID 140729894
1-methyl-3-[3-(9-pyridin-2-ylcarbazol-2-yl)oxyphenyl]-2H-benzo[e]benzimidazole
CID 164731668

Frequently Asked Questions

What is the IUPAC name of 2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole?
The IUPAC name of 2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole (CID 140730409) is 2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole.
What is the SMILES notation for 2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole?
The canonical SMILES for 2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole is c1ccc(-n2c3ccccc3c3ccc(Oc4cccc(-n5cc6ccccc6n5)c4)cc32)nc1.
What is the InChIKey of 2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole?
The InChIKey is DPVSWVRXJXWEMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H20N4O/c1-3-12-27-21(8-1)20-33(32-27)22-9-7-10-23(18-22)35-24-15-16-26-25-11-2-4-13-28(25)34(29(26)19-24)30-14-5-6-17-31-30/h1-20H.
What are the key properties of 2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole?
2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole has a molecular weight of 452.52 g/mol, XLogP of 7.31, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-indazol-2-ylphenoxy)-9-pyridin-2-ylcarbazole is sourced from PubChem (CID 140730409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).