10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole

C52H32N4 — CID 161141967

IUPAC10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole
SMILESc1ccc(-c2ccccc2-c2nc(-n3c4ccc(-n5c6ccccc6c6cc7ccccc7cc65)cc4c4c5ccccc5ccc43)nc3ccccc23)cc1
InChIInChI=1S/C52H32N4/c1-2-14-33(15-3-1)38-19-8-9-22-41(38)51-42-23-10-12-24-45(42)53-52(54-51)56-47-29-27-37(32-44(47)50-39-20-7-6-16-34(39)26-28-48(50)56)55-46-25-13-11-21-40(46)43-30-35-17-4-5-18-36(35)31-49(43)55/h1-32H
InChIKeyUNOGYWAFIZAPLU-UHFFFAOYSA-N
MW712.86 g/mol
LogP13.46
Rot. Bonds4

About 10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole

10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole (PubChem CID 161141967) has the molecular formula C52H32N4 and a molecular weight of 712.86 g/mol. Its IUPAC name is 10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole.

Molecular Properties

Compound Name10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole
PubChem CID161141967
Molecular FormulaC52H32N4
Molecular Weight712.86 g/mol
Exact Mass712.26
IUPAC Name10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole
SMILESc1ccc(-c2ccccc2-c2nc(-n3c4ccc(-n5c6ccccc6c6cc7ccccc7cc65)cc4c4c5ccccc5ccc43)nc3ccccc23)cc1
InChIInChI=1S/C52H32N4/c1-2-14-33(15-3-1)38-19-8-9-22-41(38)51-42-23-10-12-24-45(42)53-52(54-51)56-47-29-27-37(32-44(47)50-39-20-7-6-16-34(39)26-28-48(50)56)55-46-25-13-11-21-40(46)43-30-35-17-4-5-18-36(35)31-49(43)55/h1-32H
InChIKeyUNOGYWAFIZAPLU-UHFFFAOYSA-N
XLogP13.46
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500712.86
LogP ≤ 513.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-benzo[c]carbazol-7-yl-5-[4-(3,5-diphenylphenyl)quinazolin-2-yl]benzo[b]carbazole
CID 146375215
3-benzo[c]carbazol-7-yl-5-[4-(4-phenylphenyl)quinazolin-2-yl]benzo[b]carbazole
CID 146375569
2-carbazol-9-yl-5-(4-phenylquinazolin-2-yl)benzo[b]carbazole
CID 146374838
9-benzo[b]carbazol-5-yl-7-[4-(9-phenylcarbazol-2-yl)quinazolin-2-yl]benzo[c]carbazole
CID 162481400
12-[4-(7-phenylbenzo[c]carbazol-10-yl)quinazolin-2-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene
CID 139361712
10-benzo[b]carbazol-5-yl-7-[3-(3-naphthalen-2-ylphenyl)quinoxalin-2-yl]benzo[c]carbazole;10-benzo[c]carbazol-7-yl-7-[3-(3-naphthalen-1-ylphenyl)quinoxalin-2-yl]benzo[c]carbazole;10-benzo[c]carbazol-7-yl-7-[4-(9-phenylcarbazol-4-yl)quinazolin-2-yl]benzo[c]carbazole
CID 163628288
10-benzo[c]carbazol-7-yl-7-[4-(9-phenylcarbazol-2-yl)quinazolin-2-yl]benzo[c]carbazole
CID 162481241
7-(4-phenylphenyl)-10-[7-(4-phenylquinazolin-2-yl)benzo[c]carbazol-10-yl]benzo[c]carbazole;7-(4-phenylphenyl)-10-[9-(4-phenylquinazolin-2-yl)carbazol-3-yl]benzo[c]carbazole
CID 165103211
5-(4-naphthalen-1-ylquinazolin-2-yl)-3-[9-(4-phenylphenyl)carbazol-3-yl]benzo[b]carbazole
CID 142474116
7-(4-naphthalen-2-ylphenyl)-10-[9-(4-phenylquinazolin-2-yl)carbazol-3-yl]benzo[c]carbazole
CID 164784298
2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole
CID 146375723
19-benzo[b]carbazol-5-yl-12-(4-phenylquinazolin-2-yl)-23-oxa-12-azahexacyclo[11.11.0.02,11.03,8.016,24.017,22]tetracosa-1(13),2(11),3,5,7,9,14,16(24),17(22),18,20-undecaene
CID 155335645

Frequently Asked Questions

What is the IUPAC name of 10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole?
The IUPAC name of 10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole (CID 161141967) is 10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole.
What is the SMILES notation for 10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole?
The canonical SMILES for 10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole is c1ccc(-c2ccccc2-c2nc(-n3c4ccc(-n5c6ccccc6c6cc7ccccc7cc65)cc4c4c5ccccc5ccc43)nc3ccccc23)cc1.
What is the InChIKey of 10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole?
The InChIKey is UNOGYWAFIZAPLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H32N4/c1-2-14-33(15-3-1)38-19-8-9-22-41(38)51-42-23-10-12-24-45(42)53-52(54-51)56-47-29-27-37(32-44(47)50-39-20-7-6-16-34(39)26-28-48(50)56)55-46-25-13-11-21-40(46)43-30-35-17-4-5-18-36(35)31-49(43)55/h1-32H.
What are the key properties of 10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole?
10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole has a molecular weight of 712.86 g/mol, XLogP of 13.46, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole is sourced from PubChem (CID 161141967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).