4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole

C26H18N2 — CID 90257487

IUPAC4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole
SMILESc1ccc(-c2c3cc[nH]c3cc3c2c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C26H18N2/c1-3-9-18(10-4-1)25-20-15-16-27-22(20)17-24-26(25)21-13-7-8-14-23(21)28(24)19-11-5-2-6-12-19/h1-17,27H
InChIKeyTWHCMXRJCCSMQD-UHFFFAOYSA-N
MW358.44 g/mol
LogP6.93
Rot. Bonds2

About 4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole

4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole (PubChem CID 90257487) has the molecular formula C26H18N2 and a molecular weight of 358.44 g/mol. Its IUPAC name is 4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole.

Molecular Properties

Compound Name4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole
PubChem CID90257487
Molecular FormulaC26H18N2
Molecular Weight358.44 g/mol
Exact Mass358.15
IUPAC Name4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole
SMILESc1ccc(-c2c3cc[nH]c3cc3c2c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C26H18N2/c1-3-9-18(10-4-1)25-20-15-16-27-22(20)17-24-26(25)21-13-7-8-14-23(21)28(24)19-11-5-2-6-12-19/h1-17,27H
InChIKeyTWHCMXRJCCSMQD-UHFFFAOYSA-N
XLogP6.93
TPSA20.72 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.44
LogP ≤ 56.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3,4,9-triphenylpyrrolo[3,2-b]carbazole
CID 144661764
7-phenyl-12-(9-phenylcarbazol-3-yl)-5-(4-phenylphenyl)indolo[2,3-b]carbazole
CID 146368712
1-benzyl-4,9-diphenylpyrrolo[2,3-b]carbazole
CID 90257533
3-phenyl-N-[3-(5-phenylbenzo[b]carbazol-11-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167195423
5,12-diphenyl-11-(3-phenylphenyl)indolo[3,2-b]carbazole
CID 168727741
2-chloro-4,9-diphenylcarbazole
CID 165155449
3,5-diphenyl-N-[3-(5-phenylbenzo[b]carbazol-11-yl)phenyl]-N-(3-phenylphenyl)aniline
CID 166659620
3-(5-phenylbenzo[b]carbazol-11-yl)-N,N-bis[4-(3-phenylphenyl)phenyl]aniline
CID 167194690
5-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-7,12-diphenylindolo[2,3-b]carbazole
CID 170255499
3-methyl-4-phenyl-9-(9-phenylcarbazol-3-yl)carbazole
CID 170365233
2,9-diphenylcarbazol-4-amine
CID 154950470
9-[4-[10-(3-phenyl-1H-indol-2-yl)anthracen-9-yl]phenyl]carbazole
CID 123646145

Frequently Asked Questions

What is the IUPAC name of 4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole?
The IUPAC name of 4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole (CID 90257487) is 4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole.
What is the SMILES notation for 4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole?
The canonical SMILES for 4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole is c1ccc(-c2c3cc[nH]c3cc3c2c2ccccc2n3-c2ccccc2)cc1.
What is the InChIKey of 4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole?
The InChIKey is TWHCMXRJCCSMQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N2/c1-3-9-18(10-4-1)25-20-15-16-27-22(20)17-24-26(25)21-13-7-8-14-23(21)28(24)19-11-5-2-6-12-19/h1-17,27H.
What are the key properties of 4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole?
4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole has a molecular weight of 358.44 g/mol, XLogP of 6.93, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,9-diphenyl-1H-pyrrolo[2,3-b]carbazole is sourced from PubChem (CID 90257487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).