7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine

C43H28N2 — CID 154589105

IUPAC7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine
SMILESc1ccc(-c2nc(-c3ccc4c(c3)-c3cc5ccccc5cc3C4(c3ccccc3)c3ccccc3)cc3ncccc23)cc1
InChIInChI=1S/C43H28N2/c1-4-13-29(14-5-1)42-35-21-12-24-44-41(35)28-40(45-42)32-22-23-38-36(26-32)37-25-30-15-10-11-16-31(30)27-39(37)43(38,33-17-6-2-7-18-33)34-19-8-3-9-20-34/h1-28H
InChIKeyFENYLUDQZGZWQX-UHFFFAOYSA-N
MW572.71 g/mol
LogP10.48
Rot. Bonds4

About 7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine

7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine (PubChem CID 154589105) has the molecular formula C43H28N2 and a molecular weight of 572.71 g/mol. Its IUPAC name is 7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine.

Molecular Properties

Compound Name7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine
PubChem CID154589105
Molecular FormulaC43H28N2
Molecular Weight572.71 g/mol
Exact Mass572.23
IUPAC Name7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine
SMILESc1ccc(-c2nc(-c3ccc4c(c3)-c3cc5ccccc5cc3C4(c3ccccc3)c3ccccc3)cc3ncccc23)cc1
InChIInChI=1S/C43H28N2/c1-4-13-29(14-5-1)42-35-21-12-24-44-41(35)28-40(45-42)32-22-23-38-36(26-32)37-25-30-15-10-11-16-31(30)27-39(37)43(38,33-17-6-2-7-18-33)34-19-8-3-9-20-34/h1-28H
InChIKeyFENYLUDQZGZWQX-UHFFFAOYSA-N
XLogP10.48
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500572.71
LogP ≤ 510.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(9,9-diphenylfluoren-2-yl)-2-[4-(9,9-diphenylfluoren-3-yl)naphthalen-1-yl]-6-phenylpyrimidine
CID 168777926
2-(11,11-diphenylbenzo[b]fluoren-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine
CID 164829465
4-[4-(9,9-diphenylfluoren-3-yl)naphthalen-1-yl]-6-naphthalen-2-yl-2-(4-phenylphenyl)pyrimidine
CID 168778142
10,10-diphenyl-14-(4-pyridin-2-ylphenyl)-15-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 129124209
2-[4-(9,9-diphenylfluoren-3-yl)naphthalen-1-yl]-4,6-diphenylpyrimidine
CID 168780032
2-(11,11-diphenylbenzo[b]fluoren-8-yl)-3-phenylbenzo[f]quinoxaline
CID 155465596
4-(4-naphthalen-2-ylphenyl)-2-[7-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]-9,9-diphenylfluoren-2-yl]quinazoline
CID 144856654
6-[4-(9,9-diphenylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]quinoline
CID 151110061
10,10-diphenyl-14-[3-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]-15-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;10,10-diphenyl-14-[3-(4-phenylquinazolin-2-yl)phenyl]-15-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;10,10-diphenyl-14-[3-(2,4,6-triphenylpyrimidin-5-yl)phenyl]-15-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;14-[3-(1,10-phenanthrolin-2-yl)phenyl]-10,10-diphenyl-15-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 158309552
3-(11,11-diphenylbenzo[b]fluoren-7-yl)-1-phenylbenzo[f]quinazoline
CID 155465505
21-[4-[6-(1,10-phenanthrolin-5-yl)quinolin-2-yl]phenyl]-10,10-diphenyl-20-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 146408697
2-[3-(9,9-diphenylfluoren-3-yl)phenyl]-4,6-diphenylpyridine
CID 134272003

Frequently Asked Questions

What is the IUPAC name of 7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine?
The IUPAC name of 7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine (CID 154589105) is 7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine.
What is the SMILES notation for 7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine?
The canonical SMILES for 7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine is c1ccc(-c2nc(-c3ccc4c(c3)-c3cc5ccccc5cc3C4(c3ccccc3)c3ccccc3)cc3ncccc23)cc1.
What is the InChIKey of 7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine?
The InChIKey is FENYLUDQZGZWQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H28N2/c1-4-13-29(14-5-1)42-35-21-12-24-44-41(35)28-40(45-42)32-22-23-38-36(26-32)37-25-30-15-10-11-16-31(30)27-39(37)43(38,33-17-6-2-7-18-33)34-19-8-3-9-20-34/h1-28H.
What are the key properties of 7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine?
7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine has a molecular weight of 572.71 g/mol, XLogP of 10.48, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(11,11-diphenylbenzo[b]fluoren-3-yl)-5-phenyl-1,6-naphthyridine is sourced from PubChem (CID 154589105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).