10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine

C139H92N12O6 — CID 159697733

IUPAC10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine
SMILESCc1cc2nc(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)c(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)nc2cc1C.Cc1ccc2nc(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)c(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)nc2c1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2nc3cc4ccccc4cc3nc2-c2ccc(N3c4ccccc4Oc4ccccc43)cc2)cc1
InChIInChI=1S/C48H30N4O2.C46H32N4O2.C45H30N4O2/c1-2-12-34-30-38-37(29-33(34)11-1)49-47(31-21-25-35(26-22-31)51-39-13-3-7-17-43(39)53-44-18-8-4-14-40(44)51)48(50-38)32-23-27-36(28-24-32)52-41-15-5-9-19-45(41)54-46-20-10-6-16-42(46)52;1-29-27-35-36(28-30(29)2)48-46(32-21-25-34(26-22-32)50-39-13-5-9-17-43(39)52-44-18-10-6-14-40(44)50)45(47-35)31-19-23-33(24-20-31)49-37-11-3-7-15-41(37)51-42-16-8-4-12-38(42)49;1-29-18-27-34-35(28-29)47-45(31-21-25-33(26-22-31)49-38-12-4-8-16-42(38)51-43-17-9-5-13-39(43)49)44(46-34)30-19-23-32(24-20-30)48-36-10-2-6-14-40(36)50-41-15-7-3-11-37(41)48/h1-30H;3-28H,1-2H3;2-28H,1H3
InChIKeyMXFPJEDVRYARCF-UHFFFAOYSA-N
MW2026.34 g/mol
LogP38.42
Rot. Bonds12

About 10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine

10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine (PubChem CID 159697733) has the molecular formula C139H92N12O6 and a molecular weight of 2026.34 g/mol. Its IUPAC name is 10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine.

Molecular Properties

Compound Name10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine
PubChem CID159697733
Molecular FormulaC139H92N12O6
Molecular Weight2026.34 g/mol
Exact Mass2024.73
IUPAC Name10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine
SMILESCc1cc2nc(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)c(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)nc2cc1C.Cc1ccc2nc(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)c(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)nc2c1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2nc3cc4ccccc4cc3nc2-c2ccc(N3c4ccccc4Oc4ccccc43)cc2)cc1
InChIInChI=1S/C48H30N4O2.C46H32N4O2.C45H30N4O2/c1-2-12-34-30-38-37(29-33(34)11-1)49-47(31-21-25-35(26-22-31)51-39-13-3-7-17-43(39)53-44-18-8-4-14-40(44)51)48(50-38)32-23-27-36(28-24-32)52-41-15-5-9-19-45(41)54-46-20-10-6-16-42(46)52;1-29-27-35-36(28-30(29)2)48-46(32-21-25-34(26-22-32)50-39-13-5-9-17-43(39)52-44-18-10-6-14-40(44)50)45(47-35)31-19-23-33(24-20-31)49-37-11-3-7-15-41(37)51-42-16-8-4-12-38(42)49;1-29-18-27-34-35(28-29)47-45(31-21-25-33(26-22-31)49-38-12-4-8-16-42(38)51-43-17-9-5-13-39(43)49)44(46-34)30-19-23-32(24-20-30)48-36-10-2-6-14-40(36)50-41-15-7-3-11-37(41)48/h1-30H;3-28H,1-2H3;2-28H,1H3
InChIKeyMXFPJEDVRYARCF-UHFFFAOYSA-N
XLogP38.42
TPSA152.16 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds12
Heavy Atoms157
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002026.34
LogP ≤ 538.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

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

Analyze 10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine with MolForge

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Related Compounds

10-[4-[3-(4-phenoxazin-10-ylphenyl)pyrazino[2,3-b]pyrazin-2-yl]phenyl]phenoxazine
CID 129037655
10-[3,4-bis(4-methylphenyl)phenyl]phenoxazine
CID 58251267
2-[4-(6,7-dimethyl-3-phenylquinoxalin-2-yl)phenyl]-6,7-dimethyl-3-phenylquinoxaline
CID 58299261
10-[9,10-bis(2-naphthalen-2-ylphenyl)-6-phenoxazin-10-ylanthracen-2-yl]phenoxazine
CID 59221101
3-(4-methoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-6-methylquinoxalin-2-yl]phenyl]-6-methylquinoxaline
CID 58883088
10-[4-[4,6-bis[4-(9,9-dimethylacridin-10-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]phenoxazine
CID 118528556
10-(3-methyl-5-phenoxazin-10-ylphenyl)phenoxazine
CID 145413452
10-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenoxazine
CID 118528356
10-(4-methylphenyl)-3,7-diphenylphenoxazine
CID 58556205
N-[4-[2,3-dimethyl-5-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]benzo[b]phenazin-12-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 20767452
10-(3,5-dinaphthalen-2-ylphenyl)phenoxazine
CID 58251173
10-[4-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenoxazine
CID 118528381

Frequently Asked Questions

What is the IUPAC name of 10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine?
The IUPAC name of 10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine (CID 159697733) is 10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine.
What is the SMILES notation for 10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine?
The canonical SMILES for 10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine is Cc1cc2nc(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)c(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)nc2cc1C.Cc1ccc2nc(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)c(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)nc2c1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2nc3cc4ccccc4cc3nc2-c2ccc(N3c4ccccc4Oc4ccccc43)cc2)cc1.
What is the InChIKey of 10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine?
The InChIKey is MXFPJEDVRYARCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N4O2.C46H32N4O2.C45H30N4O2/c1-2-12-34-30-38-37(29-33(34)11-1)49-47(31-21-25-35(26-22-31)51-39-13-3-7-17-43(39)53-44-18-8-4-14-40(44)51)48(50-38)32-23-27-36(28-24-32)52-41-15-5-9-19-45(41)54-46-20-10-6-16-42(46)52;1-29-27-35-36(28-30(29)2)48-46(32-21-25-34(26-22-32)50-39-13-5-9-17-43(39)52-44-18-10-6-14-40(44)50)45(47-35)31-19-23-33(24-20-31)49-37-11-3-7-15-41(37)51-42-16-8-4-12-38(42)49;1-29-18-27-34-35(28-29)47-45(31-21-25-33(26-22-31)49-38-12-4-8-16-42(38)51-43-17-9-5-13-39(43)49)44(46-34)30-19-23-32(24-20-30)48-36-10-2-6-14-40(36)50-41-15-7-3-11-37(41)48/h1-30H;3-28H,1-2H3;2-28H,1H3.
What are the key properties of 10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine?
10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine has a molecular weight of 2026.34 g/mol, XLogP of 38.42, 12 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[4-[6,7-dimethyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[6-methyl-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine;10-[4-[3-(4-phenoxazin-10-ylphenyl)benzo[g]quinoxalin-2-yl]phenyl]phenoxazine is sourced from PubChem (CID 159697733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).