1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole

C42H28N2 — CID 137466576

IUPAC1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4cccc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)c43)c2)cc1
InChIInChI=1S/C42H28N2/c1-3-14-29(15-4-1)30-16-11-19-32(28-30)44-40-27-10-8-21-34(40)36-23-13-25-38(42(36)44)37-24-12-22-35-33-20-7-9-26-39(33)43(41(35)37)31-17-5-2-6-18-31/h1-28H
InChIKeyYSEONMWCOSEAAK-UHFFFAOYSA-N
MW560.70 g/mol
LogP11.21
Rot. Bonds4

About 1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole

1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole (PubChem CID 137466576) has the molecular formula C42H28N2 and a molecular weight of 560.70 g/mol. Its IUPAC name is 1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole.

Molecular Properties

Compound Name1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole
PubChem CID137466576
Molecular FormulaC42H28N2
Molecular Weight560.70 g/mol
Exact Mass560.23
IUPAC Name1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4cccc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)c43)c2)cc1
InChIInChI=1S/C42H28N2/c1-3-14-29(15-4-1)30-16-11-19-32(28-30)44-40-27-10-8-21-34(40)36-23-13-25-38(42(36)44)37-24-12-22-35-33-20-7-9-26-39(33)43(41(35)37)31-17-5-2-6-18-31/h1-28H
InChIKeyYSEONMWCOSEAAK-UHFFFAOYSA-N
XLogP11.21
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500560.70
LogP ≤ 511.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-phenyl-1-[2-(3-phenylphenyl)phenyl]carbazole
CID 175012916
1-(9-phenylcarbazol-1-yl)-9-[3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 155305816
4-(9-phenylcarbazol-1-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole
CID 164821252
9-phenyl-1-[3-[3-phenyl-5-(9-phenylcarbazol-1-yl)phenyl]phenyl]carbazole
CID 71127197
3,9-diphenyl-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole;3,9-diphenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole;1-phenyl-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 160580937
1-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]carbazole
CID 154590389
11-phenyl-12-[9-(3-phenylphenyl)carbazol-1-yl]indolo[2,3-a]carbazole
CID 164800329
11-[3-(4-phenylphenyl)phenyl]-12-[3-[11-[3-(4-phenylphenyl)phenyl]indolo[2,3-a]carbazol-12-yl]phenyl]indolo[2,3-a]carbazole
CID 170394025
3-[9-(3,5-diphenylphenyl)carbazol-1-yl]-9-(4-phenylphenyl)carbazole;3-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole;9-(3-phenylphenyl)-1-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 159712744
2-(9-phenylcarbazol-4-yl)-9-(4-phenylphenyl)carbazole;4-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole;9-(3-phenylphenyl)-4-[9-(4-phenylphenyl)carbazol-2-yl]carbazole
CID 162097469
6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-1,9-diphenylcarbazole
CID 170072372
11-phenyl-12-[4-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]indolo[2,3-a]carbazole
CID 134168606

Frequently Asked Questions

What is the IUPAC name of 1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole?
The IUPAC name of 1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole (CID 137466576) is 1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole.
What is the SMILES notation for 1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole?
The canonical SMILES for 1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole is c1ccc(-c2cccc(-n3c4ccccc4c4cccc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)c43)c2)cc1.
What is the InChIKey of 1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole?
The InChIKey is YSEONMWCOSEAAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28N2/c1-3-14-29(15-4-1)30-16-11-19-32(28-30)44-40-27-10-8-21-34(40)36-23-13-25-38(42(36)44)37-24-12-22-35-33-20-7-9-26-39(33)43(41(35)37)31-17-5-2-6-18-31/h1-28H.
What are the key properties of 1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole?
1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole has a molecular weight of 560.70 g/mol, XLogP of 11.21, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole is sourced from PubChem (CID 137466576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).