7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole

C42H27N5 — CID 141295897

IUPAC7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole
SMILESc1ccc(-n2c3cc(-c4ccc(-c5ccccn5)nc4)ccc3c3c4ccccc4c(-c4ccc(-c5ccccn5)nc4)cc32)cc1
InChIInChI=1S/C42H27N5/c1-2-10-31(11-3-1)47-40-24-28(29-17-20-38(45-26-29)36-14-6-8-22-43-36)16-19-34(40)42-33-13-5-4-12-32(33)35(25-41(42)47)30-18-21-39(46-27-30)37-15-7-9-23-44-37/h1-27H
InChIKeyANSZJDNBLNOHAN-UHFFFAOYSA-N
MW601.71 g/mol
LogP10.18
Rot. Bonds5

About 7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole

7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole (PubChem CID 141295897) has the molecular formula C42H27N5 and a molecular weight of 601.71 g/mol. Its IUPAC name is 7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole.

Molecular Properties

Compound Name7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole
PubChem CID141295897
Molecular FormulaC42H27N5
Molecular Weight601.71 g/mol
Exact Mass601.23
IUPAC Name7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole
SMILESc1ccc(-n2c3cc(-c4ccc(-c5ccccn5)nc4)ccc3c3c4ccccc4c(-c4ccc(-c5ccccn5)nc4)cc32)cc1
InChIInChI=1S/C42H27N5/c1-2-10-31(11-3-1)47-40-24-28(29-17-20-38(45-26-29)36-14-6-8-22-43-36)16-19-34(40)42-33-13-5-4-12-32(33)35(25-41(42)47)30-18-21-39(46-27-30)37-15-7-9-23-44-37/h1-27H
InChIKeyANSZJDNBLNOHAN-UHFFFAOYSA-N
XLogP10.18
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500601.71
LogP ≤ 510.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[5-(7-phenylbenzo[c]carbazol-5-yl)-2-pyridinyl]pyridine-4-carbonitrile
CID 118397522
2-[5-[15-[6-(4-cyano-2-pyridinyl)-3-pyridinyl]-12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]-2-pyridinyl]pyridine-4-carbonitrile
CID 118397792
4,4,5,5-tetramethyl-2-[5-(9-naphthalen-2-yl-7-phenylbenzo[c]carbazol-5-yl)-2-pyridinyl]-1,3-oxazole
CID 135249789
2-[6-[9-[5-(4,5-dihydro-1,3-oxazol-2-yl)-2-pyridinyl]-7-phenylbenzo[c]carbazol-5-yl]-3-pyridinyl]-4,5-dihydro-1,3-oxazole
CID 135250126
9-phenyl-3-[4-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-3-pyridinyl]phenyl]carbazole
CID 164817113
4-(5,7-diphenylbenzo[g]carbazol-9-yl)pyridine-2-carbonitrile
CID 118397508
9-phenyl-2-[6-(10-phenylanthracen-9-yl)-3-pyridinyl]carbazole
CID 147817509
5-(4-phenyl-2-pyridinyl)-7-(3-pyridin-2-ylphenyl)benzo[c]carbazole
CID 159887886
CID 159471521
CID 159471521
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
9-phenyl-2-[3-(9-phenylcarbazol-2-yl)-5-[4-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]phenyl]carbazole
CID 118289394
5-[4-[5-[4-(5-cyano-3-pyridinyl)phenyl]-7-phenylbenzo[g]carbazol-9-yl]phenyl]pyridine-3-carbonitrile
CID 118397694

Frequently Asked Questions

What is the IUPAC name of 7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole?
The IUPAC name of 7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole (CID 141295897) is 7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole.
What is the SMILES notation for 7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole?
The canonical SMILES for 7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole is c1ccc(-n2c3cc(-c4ccc(-c5ccccn5)nc4)ccc3c3c4ccccc4c(-c4ccc(-c5ccccn5)nc4)cc32)cc1.
What is the InChIKey of 7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole?
The InChIKey is ANSZJDNBLNOHAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H27N5/c1-2-10-31(11-3-1)47-40-24-28(29-17-20-38(45-26-29)36-14-6-8-22-43-36)16-19-34(40)42-33-13-5-4-12-32(33)35(25-41(42)47)30-18-21-39(46-27-30)37-15-7-9-23-44-37/h1-27H.
What are the key properties of 7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole?
7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole has a molecular weight of 601.71 g/mol, XLogP of 10.18, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-5,9-bis(6-pyridin-2-yl-3-pyridinyl)benzo[c]carbazole is sourced from PubChem (CID 141295897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).