4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol

C27H20N4O2 — CID 176606675

IUPAC4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol
SMILESCc1ccc2c(C)cc(Oc3ccc4c5ccccc5n(-c5cnccn5)c4c3)nc2c1O
InChIInChI=1S/C27H20N4O2/c1-16-7-9-19-17(2)13-25(30-26(19)27(16)32)33-18-8-10-21-20-5-3-4-6-22(20)31(23(21)14-18)24-15-28-11-12-29-24/h3-15,32H,1-2H3
InChIKeyGJBACAWTBYUHHZ-UHFFFAOYSA-N
MW432.48 g/mol
LogP6.24
Rot. Bonds3

About 4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol

4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol (PubChem CID 176606675) has the molecular formula C27H20N4O2 and a molecular weight of 432.48 g/mol. Its IUPAC name is 4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol.

Molecular Properties

Compound Name4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol
PubChem CID176606675
Molecular FormulaC27H20N4O2
Molecular Weight432.48 g/mol
Exact Mass432.16
IUPAC Name4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol
SMILESCc1ccc2c(C)cc(Oc3ccc4c5ccccc5n(-c5cnccn5)c4c3)nc2c1O
InChIInChI=1S/C27H20N4O2/c1-16-7-9-19-17(2)13-25(30-26(19)27(16)32)33-18-8-10-21-20-5-3-4-6-22(20)31(23(21)14-18)24-15-28-11-12-29-24/h3-15,32H,1-2H3
InChIKeyGJBACAWTBYUHHZ-UHFFFAOYSA-N
XLogP6.24
TPSA73.06 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.48
LogP ≤ 56.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-propan-2-yl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol
CID 176606879
2-(6-tert-butyl-9-pyrazin-2-ylcarbazol-2-yl)oxy-4,6-dimethylquinolin-8-ol
CID 176606279
2-(5-tert-butyl-9-pyridin-2-ylcarbazol-2-yl)oxy-4,7-dimethylquinolin-8-ol
CID 176606114
2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol
CID 176606434
2-[3-[(5-methyl-2-pyridinyl)oxy]phenyl]-9-pyrazin-2-ylcarbazole
CID 157488582
4-methyl-2-[9-(5-methyl-2-pyridinyl)-6-propan-2-ylcarbazol-2-yl]oxyquinolin-8-ol
CID 176605878
5,7-dimethyl-2-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum
CID 176605982
2-[9-(4,6-diphenyl-2-pyridinyl)carbazol-2-yl]oxy-4,5-dimethylquinolin-8-ol
CID 176606407
5-carbazol-9-yl-2-(9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol
CID 176606537
4-methyl-9-(9-pyridin-2-ylcarbazol-2-yl)oxy-2,3,8,15-tetrazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),3,5,7(12),8,10,14,16-octaene
CID 140949948
2-(8-tert-butyl-5-methyl-9-pyridin-2-ylcarbazol-2-yl)oxy-4-methyl-7-propan-2-ylquinolin-8-ol
CID 176606245
9-(9-pyridin-2-ylcarbazol-2-yl)oxy-2,8,15-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),3,5,7(12),8,10,14,16-octaene
CID 140949626

Frequently Asked Questions

What is the IUPAC name of 4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol?
The IUPAC name of 4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol (CID 176606675) is 4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol.
What is the SMILES notation for 4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol?
The canonical SMILES for 4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol is Cc1ccc2c(C)cc(Oc3ccc4c5ccccc5n(-c5cnccn5)c4c3)nc2c1O.
What is the InChIKey of 4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol?
The InChIKey is GJBACAWTBYUHHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H20N4O2/c1-16-7-9-19-17(2)13-25(30-26(19)27(16)32)33-18-8-10-21-20-5-3-4-6-22(20)31(23(21)14-18)24-15-28-11-12-29-24/h3-15,32H,1-2H3.
What are the key properties of 4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol?
4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol has a molecular weight of 432.48 g/mol, XLogP of 6.24, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol is sourced from PubChem (CID 176606675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).