2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline

C43H28N2 — CID 155465500

IUPAC2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline
SMILESc1ccc(-c2nc3ccccc3nc2-c2ccc3c4c(ccc3c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)cc1
InChIInChI=1S/C43H28N2/c1-4-14-29(15-5-1)41-42(45-39-23-13-12-22-38(39)44-41)31-24-26-34-30(28-31)25-27-37-40(34)35-20-10-11-21-36(35)43(37,32-16-6-2-7-17-32)33-18-8-3-9-19-33/h1-28H
InChIKeyBFTILHUXZVSFHN-UHFFFAOYSA-N
MW572.71 g/mol
LogP10.48
Rot. Bonds4

About 2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline

2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline (PubChem CID 155465500) has the molecular formula C43H28N2 and a molecular weight of 572.71 g/mol. Its IUPAC name is 2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline.

Molecular Properties

Compound Name2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline
PubChem CID155465500
Molecular FormulaC43H28N2
Molecular Weight572.71 g/mol
Exact Mass572.23
IUPAC Name2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline
SMILESc1ccc(-c2nc3ccccc3nc2-c2ccc3c4c(ccc3c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)cc1
InChIInChI=1S/C43H28N2/c1-4-14-29(15-5-1)41-42(45-39-23-13-12-22-38(39)44-41)31-24-26-34-30(28-31)25-27-37-40(34)35-20-10-11-21-36(35)43(37,32-16-6-2-7-17-32)33-18-8-3-9-19-33/h1-28H
InChIKeyBFTILHUXZVSFHN-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

2-(7,7-diphenylbenzo[c]fluoren-3-yl)-4,6-diphenyl-1,3,5-triazine
CID 155465814
2-(11,11-diphenylbenzo[b]fluoren-5-yl)-3-phenylquinoxaline
CID 149393432
2-[4-(7,7-diphenylbenzo[c]fluoren-3-yl)naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine
CID 155465894
1-[3-[4-(7,7-diphenylbenzo[c]fluoren-3-yl)phenyl]quinoxalin-2-yl]-9-phenylcarbazole
CID 155465753
2-[4-(7,7-diphenylbenzo[c]fluoren-2-yl)phenyl]-4-phenylquinazoline
CID 155465448
21-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-9,9-diphenyl-20-azapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene
CID 129124168
2-(11,11-diphenylbenzo[b]fluoren-6-yl)-3-phenylquinoxaline
CID 155465410
2-(17,17-dimethyl-6-hexacyclo[12.11.0.02,11.03,8.016,24.018,23]pentacosa-1(25),2(11),3(8),4,6,9,12,14,16(24),18,20,22-dodecaenyl)-3-phenylquinoxaline
CID 164721534
2-(23,23-dimethyl-6-hexacyclo[12.11.0.02,11.03,8.016,24.017,22]pentacosa-1(25),2(11),3(8),4,6,9,12,14,16(24),17,19,21-dodecaenyl)-3-phenylquinoxaline
CID 164721777
21-(4-bromophenyl)-9,9-diphenyl-20-azapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene
CID 129124443
2-[7-(9,9-diphenylfluoren-4-yl)naphthalen-2-yl]-4-naphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine
CID 162196091
3-(7,7-dimethylbenzo[c]fluoren-3-yl)-2-phenylbenzo[f]quinoxaline
CID 155465499

Frequently Asked Questions

What is the IUPAC name of 2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline?
The IUPAC name of 2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline (CID 155465500) is 2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline.
What is the SMILES notation for 2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline?
The canonical SMILES for 2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline is c1ccc(-c2nc3ccccc3nc2-c2ccc3c4c(ccc3c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)cc1.
What is the InChIKey of 2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline?
The InChIKey is BFTILHUXZVSFHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H28N2/c1-4-14-29(15-5-1)41-42(45-39-23-13-12-22-38(39)44-41)31-24-26-34-30(28-31)25-27-37-40(34)35-20-10-11-21-36(35)43(37,32-16-6-2-7-17-32)33-18-8-3-9-19-33/h1-28H.
What are the key properties of 2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline?
2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline 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 2-(7,7-diphenylbenzo[c]fluoren-3-yl)-3-phenylquinoxaline is sourced from PubChem (CID 155465500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).