[4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol

C26H20N2O2 — CID 162475875

IUPAC[4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol
SMILESCOc1ccc(-c2nc3cc4ccccc4cc3nc2-c2ccc(CO)cc2)cc1
InChIInChI=1S/C26H20N2O2/c1-30-22-12-10-19(11-13-22)26-25(18-8-6-17(16-29)7-9-18)27-23-14-20-4-2-3-5-21(20)15-24(23)28-26/h2-15,29H,16H2,1H3
InChIKeyFSDBWFNSIHZQSM-UHFFFAOYSA-N
MW392.46 g/mol
LogP5.62
Rot. Bonds4

About [4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol

[4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol (PubChem CID 162475875) has the molecular formula C26H20N2O2 and a molecular weight of 392.46 g/mol. Its IUPAC name is [4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol.

Molecular Properties

Compound Name[4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol
PubChem CID162475875
Molecular FormulaC26H20N2O2
Molecular Weight392.46 g/mol
Exact Mass392.15
IUPAC Name[4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol
SMILESCOc1ccc(-c2nc3cc4ccccc4cc3nc2-c2ccc(CO)cc2)cc1
InChIInChI=1S/C26H20N2O2/c1-30-22-12-10-19(11-13-22)26-25(18-8-6-17(16-29)7-9-18)27-23-14-20-4-2-3-5-21(20)15-24(23)28-26/h2-15,29H,16H2,1H3
InChIKeyFSDBWFNSIHZQSM-UHFFFAOYSA-N
XLogP5.62
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.46
LogP ≤ 55.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

2,3-bis(4-methoxyphenyl)naphtho[2,3-g]quinoxaline
CID 121258930
2,3-bis(4-methoxyphenyl)naphtho[2,3-g]quinoxaline;methane
CID 145053980
2-(4-ethylphenyl)-3-(4-fluorophenyl)benzo[g]quinoxaline;4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenol
CID 177047062
(4-methoxyphenyl)methanol
CID 7738
4-[3-(4-hydroxy-3-methoxyphenyl)benzo[g]quinoxalin-2-yl]-2-methoxyphenol
CID 1309066
2-[4-[4-(hydroxymethyl)phenyl]-6-(4-methoxyphenyl)-1,3,5-triazin-2-yl]phenol
CID 135597460
cycloheptane;(4-methoxyphenyl)methanol
CID 142801335
6-chloro-2-(4-methoxyphenyl)-3-phenylquinoxaline
CID 118726434
2,3-bis(4-methoxyphenyl)-6-(methylsulfonylmethyl)quinoxaline
CID 148501353
3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline
CID 58883088
[4-[4-amino-3-(4-methoxyphenyl)phenyl]phenyl]methanol
CID 143026466
2,3,8,9-tetrakis(4-methoxyphenyl)pyrazino[2,3-f]quinoxaline
CID 15620164

Frequently Asked Questions

What is the IUPAC name of [4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol?
The IUPAC name of [4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol (CID 162475875) is [4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol.
What is the SMILES notation for [4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol?
The canonical SMILES for [4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol is COc1ccc(-c2nc3cc4ccccc4cc3nc2-c2ccc(CO)cc2)cc1.
What is the InChIKey of [4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol?
The InChIKey is FSDBWFNSIHZQSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N2O2/c1-30-22-12-10-19(11-13-22)26-25(18-8-6-17(16-29)7-9-18)27-23-14-20-4-2-3-5-21(20)15-24(23)28-26/h2-15,29H,16H2,1H3.
What are the key properties of [4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol?
[4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol has a molecular weight of 392.46 g/mol, XLogP of 5.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[3-(4-methoxyphenyl)benzo[g]quinoxalin-2-yl]phenyl]methanol is sourced from PubChem (CID 162475875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).