5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine

C79H52N6 — CID 165044371

IUPAC5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine
SMILESCc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(N3c4ccccc4N(c4ccccc4)c4ccccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C79H52N6/c1-51-26-25-27-52(50-51)74-75(81-62-38-13-5-30-54(62)55-31-6-14-39-63(55)81)77(83-66-42-17-9-34-58(66)59-35-10-18-43-67(59)83)79(85-72-48-23-21-46-70(72)80(53-28-3-2-4-29-53)71-47-22-24-49-73(71)85)78(84-68-44-19-11-36-60(68)61-37-12-20-45-69(61)84)76(74)82-64-40-15-7-32-56(64)57-33-8-16-41-65(57)82/h2-50H,1H3
InChIKeyNFGSCMMCINKTLC-UHFFFAOYSA-N
MW1085.33 g/mol
LogP21.30
Rot. Bonds7

About 5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine

5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine (PubChem CID 165044371) has the molecular formula C79H52N6 and a molecular weight of 1085.33 g/mol. Its IUPAC name is 5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine.

Molecular Properties

Compound Name5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine
PubChem CID165044371
Molecular FormulaC79H52N6
Molecular Weight1085.33 g/mol
Exact Mass1084.43
IUPAC Name5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine
SMILESCc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(N3c4ccccc4N(c4ccccc4)c4ccccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C79H52N6/c1-51-26-25-27-52(50-51)74-75(81-62-38-13-5-30-54(62)55-31-6-14-39-63(55)81)77(83-66-42-17-9-34-58(66)59-35-10-18-43-67(59)83)79(85-72-48-23-21-46-70(72)80(53-28-3-2-4-29-53)71-47-22-24-49-73(71)85)78(84-68-44-19-11-36-60(68)61-37-12-20-45-69(61)84)76(74)82-64-40-15-7-32-56(64)57-33-8-16-41-65(57)82/h2-50H,1H3
InChIKeyNFGSCMMCINKTLC-UHFFFAOYSA-N
XLogP21.30
TPSA26.20 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms85
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001085.33
LogP ≤ 521.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

3-(3-carbazol-9-ylpropoxy)-9-[3,5-di(carbazol-9-yl)-6-[3-(3-carbazol-9-ylpropoxy)carbazol-9-yl]-4-(3-methylphenyl)-2-pyridinyl]carbazole;5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine
CID 165044370
12-phenyl-5-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]indolo[3,2-c]carbazole
CID 165016795
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole
CID 162048953
5-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole
CID 165061618
3-[9-[4-[3-(3-methylphenyl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[3-(4-methylphenyl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 160753219
3-[9-[3-methyl-5-(3-methylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 134370775
3-(9-phenylcarbazol-3-yl)-9-[2,4,6-tri(carbazol-9-yl)-3,5-bis[3-(trifluoromethyl)phenyl]phenyl]carbazole
CID 167107982
4-[2-(3-methylphenyl)carbazol-9-yl]-2-(3-phenylphenyl)isoindole-1,3-dione
CID 134234241
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole
CID 158304172
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole
CID 160614579
3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole
CID 170198467
11-carbazol-9-yl-4,8,14,18-tetraphenyl-1,8,14-triazapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene
CID 171467608

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine?
The IUPAC name of 5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine (CID 165044371) is 5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine.
What is the SMILES notation for 5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine?
The canonical SMILES for 5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine is Cc1cccc(-c2c(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)c(N3c4ccccc4N(c4ccccc4)c4ccccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of 5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine?
The InChIKey is NFGSCMMCINKTLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C79H52N6/c1-51-26-25-27-52(50-51)74-75(81-62-38-13-5-30-54(62)55-31-6-14-39-63(55)81)77(83-66-42-17-9-34-58(66)59-35-10-18-43-67(59)83)79(85-72-48-23-21-46-70(72)80(53-28-3-2-4-29-53)71-47-22-24-49-73(71)85)78(84-68-44-19-11-36-60(68)61-37-12-20-45-69(61)84)76(74)82-64-40-15-7-32-56(64)57-33-8-16-41-65(57)82/h2-50H,1H3.
What are the key properties of 5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine?
5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine has a molecular weight of 1085.33 g/mol, XLogP of 21.30, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-10-[2,3,5,6-tetra(carbazol-9-yl)-4-(3-methylphenyl)phenyl]phenazine is sourced from PubChem (CID 165044371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).