6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine

C40H24N6 — CID 163816869

IUPAC6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine
SMILESc1cnc2nc3c4ccccc4n(-c4ccc(-c5ccc(-n6c7ccccc7c7nc8ncccc8cc76)cc5)cc4)c3cc2c1
InChIInChI=1S/C40H24N6/c1-3-11-33-31(9-1)37-35(23-27-7-5-21-41-39(27)43-37)45(33)29-17-13-25(14-18-29)26-15-19-30(20-16-26)46-34-12-4-2-10-32(34)38-36(46)24-28-8-6-22-42-40(28)44-38/h1-24H
InChIKeyNSBWORLELZUBPE-UHFFFAOYSA-N
MW588.67 g/mol
LogP9.43
Rot. Bonds3

About 6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine

6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine (PubChem CID 163816869) has the molecular formula C40H24N6 and a molecular weight of 588.67 g/mol. Its IUPAC name is 6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine.

Molecular Properties

Compound Name6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine
PubChem CID163816869
Molecular FormulaC40H24N6
Molecular Weight588.67 g/mol
Exact Mass588.21
IUPAC Name6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine
SMILESc1cnc2nc3c4ccccc4n(-c4ccc(-c5ccc(-n6c7ccccc7c7nc8ncccc8cc76)cc5)cc4)c3cc2c1
InChIInChI=1S/C40H24N6/c1-3-11-33-31(9-1)37-35(23-27-7-5-21-41-39(27)43-37)45(33)29-17-13-25(14-18-29)26-15-19-30(20-16-26)46-34-12-4-2-10-32(34)38-36(46)24-28-8-6-22-42-40(28)44-38/h1-24H
InChIKeyNSBWORLELZUBPE-UHFFFAOYSA-N
XLogP9.43
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500588.67
LogP ≤ 59.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine with MolForge

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Related Compounds

5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole
CID 147682919
3-[9-(4-phenylphenyl)carbazol-3-yl]-9-quinolin-8-ylcarbazole
CID 164797310
10-carbazol-9-yl-21,23-diazahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(20),2,4,6,8(13),9,11,14,16,18,21,23,25,27-tetradecaene
CID 134428704
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole
CID 135323607
9-[4-[4-[4-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041201
5-[4-(2-naphthalen-1-yl-6-pyridin-2-yl-4-pyridinyl)phenyl]pyrido[3,2-b]indole
CID 59326017
10-(3-phenylphenyl)-22-(4-phenylphenyl)-2,10,14,22-tetrazahexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1(24),2,4,6,8,11,13,15(23),16,18,20-undecaene;22-phenyl-10-(3-phenylphenyl)-2,10,22-triazahexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1(24),2,4,6,8,11,13,15(23),16,18,20-undecaene;22-phenyl-10-(4-phenylphenyl)-2,10,22-triazahexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1(24),2,4,6,8,11,13,15(23),16,18,20-undecaene
CID 159289819
12-(4-carbazol-9-ylphenyl)naphtho[2,1-f]quinoline
CID 89341993
8-[4-[4-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 118517438
3-(9-phenylcarbazol-3-yl)-9-(4-quinolin-8-ylphenyl)carbazole
CID 118133191
9-[4-[6-[6-(4-carbazol-9-ylphenyl)naphthalen-2-yl]naphthalen-2-yl]phenyl]carbazole
CID 58971525
2-(1H-imidazo[4,5-b]pyridin-2-yl)-9-phenylcarbazole
CID 162470933

Frequently Asked Questions

What is the IUPAC name of 6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine?
The IUPAC name of 6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine (CID 163816869) is 6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine.
What is the SMILES notation for 6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine?
The canonical SMILES for 6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine is c1cnc2nc3c4ccccc4n(-c4ccc(-c5ccc(-n6c7ccccc7c7nc8ncccc8cc76)cc5)cc4)c3cc2c1.
What is the InChIKey of 6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine?
The InChIKey is NSBWORLELZUBPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H24N6/c1-3-11-33-31(9-1)37-35(23-27-7-5-21-41-39(27)43-37)45(33)29-17-13-25(14-18-29)26-15-19-30(20-16-26)46-34-12-4-2-10-32(34)38-36(46)24-28-8-6-22-42-40(28)44-38/h1-24H.
What are the key properties of 6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine?
6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine has a molecular weight of 588.67 g/mol, XLogP of 9.43, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(4-indolo[3,2-b][1,8]naphthyridin-6-ylphenyl)phenyl]indolo[3,2-b][1,8]naphthyridine is sourced from PubChem (CID 163816869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).