9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole

C51H41N3 — CID 135249802

IUPAC9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole
SMILESCC1(C)N=C(c2ccc(-c3cc4c(c5ccccc35)c3ccc(-c5ccc6ccccc6c5)cc3n4-c3ccccc3)cc2)N(c2ccccc2)C1(C)C
InChIInChI=1S/C51H41N3/c1-50(2)51(3,4)54(41-19-9-6-10-20-41)49(52-50)36-26-24-35(25-27-36)45-33-47-48(43-22-14-13-21-42(43)45)44-30-29-39(32-46(44)53(47)40-17-7-5-8-18-40)38-28-23-34-15-11-12-16-37(34)31-38/h5-33H,1-4H3
InChIKeyGZCMNHUNPUZYIR-UHFFFAOYSA-N
MW695.91 g/mol
LogP13.25
Rot. Bonds5

About 9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole

9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole (PubChem CID 135249802) has the molecular formula C51H41N3 and a molecular weight of 695.91 g/mol. Its IUPAC name is 9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole.

Molecular Properties

Compound Name9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole
PubChem CID135249802
Molecular FormulaC51H41N3
Molecular Weight695.91 g/mol
Exact Mass695.33
IUPAC Name9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole
SMILESCC1(C)N=C(c2ccc(-c3cc4c(c5ccccc35)c3ccc(-c5ccc6ccccc6c5)cc3n4-c3ccccc3)cc2)N(c2ccccc2)C1(C)C
InChIInChI=1S/C51H41N3/c1-50(2)51(3,4)54(41-19-9-6-10-20-41)49(52-50)36-26-24-35(25-27-36)45-33-47-48(43-22-14-13-21-42(43)45)44-30-29-39(32-46(44)53(47)40-17-7-5-8-18-40)38-28-23-34-15-11-12-16-37(34)31-38/h5-33H,1-4H3
InChIKeyGZCMNHUNPUZYIR-UHFFFAOYSA-N
XLogP13.25
TPSA20.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500695.91
LogP ≤ 513.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4,4,5,5-tetramethyl-2-[5-(9-naphthalen-2-yl-7-phenylbenzo[c]carbazol-5-yl)-2-pyridinyl]-1,3-oxazole
CID 135249789
5-[3-(6-methyl-2-pyridinyl)phenyl]-9-naphthalen-2-yl-7-phenylbenzo[c]carbazole
CID 118895360
3-(10-naphthalen-2-ylanthracen-9-yl)-5-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)pyridine
CID 135249636
9-[6-(2-iodo-4,4,5,5-tetramethylimidazol-1-yl)-3-pyridinyl]-5-[6-(2,4,4,5,5-pentamethylimidazol-1-yl)-3-pyridinyl]-7-phenylbenzo[c]carbazole
CID 135252956
7-naphthalen-1-yl-5,9-dinaphthalen-2-ylbenzo[c]carbazole
CID 163423913
2-naphthalen-2-yl-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole
CID 121262529
4,4,5,5-tetramethyl-1-phenyl-2-[4-[3-(4-phenylphenyl)-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]phenyl]phenyl]imidazole
CID 135250550
2-(4-bromophenyl)-4,4,5,5-tetramethyl-1-phenylimidazole;(9,10-dinaphthalen-2-ylanthracen-2-yl)boronic acid;2-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-4,4,5,5-tetramethyl-1-phenylimidazole
CID 158287814
2-[4-[2,3-diphenyl-4-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]naphthalen-1-yl]phenyl]-4,4,5,5-tetramethyl-1-phenylimidazole
CID 135250383
2-naphthalen-2-yl-5-[2-(7-phenylbenzo[c]carbazol-5-yl)quinazolin-4-yl]benzo[b]carbazole
CID 146539916
7-phenyl-4,9-di(pyren-2-yl)benzo[c]carbazole
CID 139341378
3-(8-naphthalen-2-ylbenzo[c]phenanthren-5-yl)-9-phenylcarbazole
CID 59282542

Frequently Asked Questions

What is the IUPAC name of 9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole?
The IUPAC name of 9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole (CID 135249802) is 9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole.
What is the SMILES notation for 9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole?
The canonical SMILES for 9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole is CC1(C)N=C(c2ccc(-c3cc4c(c5ccccc35)c3ccc(-c5ccc6ccccc6c5)cc3n4-c3ccccc3)cc2)N(c2ccccc2)C1(C)C.
What is the InChIKey of 9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole?
The InChIKey is GZCMNHUNPUZYIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H41N3/c1-50(2)51(3,4)54(41-19-9-6-10-20-41)49(52-50)36-26-24-35(25-27-36)45-33-47-48(43-22-14-13-21-42(43)45)44-30-29-39(32-46(44)53(47)40-17-7-5-8-18-40)38-28-23-34-15-11-12-16-37(34)31-38/h5-33H,1-4H3.
What are the key properties of 9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole?
9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole has a molecular weight of 695.91 g/mol, XLogP of 13.25, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-naphthalen-2-yl-7-phenyl-5-[4-(4,4,5,5-tetramethyl-1-phenylimidazol-2-yl)phenyl]benzo[c]carbazole is sourced from PubChem (CID 135249802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).