2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline

C201H140N10OS — CID 158196122

About 2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline

2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline (PubChem CID 158196122) has the molecular formula C201H140N10OS and a molecular weight of 2743.47 g/mol. Its IUPAC name is 2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline.

Molecular Properties

• Compound Name: 2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline
• PubChem CID: 158196122
• Molecular Formula: C201H140N10OS
• Molecular Weight: 2743.47 g/mol
• Exact Mass: 2741.09
• IUPAC Name: 2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline
• SMILES: CC(C)(c1ccc(-c2ccc3ccc4ccccc4c3n2)cc1)c1cccc(-c2ccc3ccc4ccccc4c3n2)c1.CC(C)(c1ccc(-c2ccc3ccc4ccccc4c3n2)cc1)c1ccccc1-c1ccc2ccc3ccccc3c2n1.c1cc(Oc2ccc(-c3ccc4ccc5ccccc5c4n3)cc2)cc(-c2ccc3ccc4ccccc4c3n2)c1.c1cc(Sc2ccc(-c3ccc4ccc5ccccc5c4n3)cc2)cc(-c2ccc3ccc4ccccc4c3n2)c1.c1ccc2c(c1)ccc1ccc(-c3ccc(C4(c5ccc(-c6ccc7ccc8ccccc8c7n6)cc5)CCCC4)cc3)nc12
• InChI: InChI=1S/C43H32N2.2C41H30N2.C38H24N2O.C38H24N2S/c1-3-9-37-29(7-1)11-13-33-19-25-39(44-41(33)37)31-15-21-35(22-16-31)43(27-5-6-28-43)36-23-17-32(18-24-36)40-26-20-34-14-12-30-8-2-4-10-38(30)42(34)45-40;1-41(2,32-23-19-29(20-24-32)37-25-21-30-17-15-27-9-3-5-11-33(27)39(30)42-37)36-14-8-7-13-35(36)38-26-22-31-18-16-28-10-4-6-12-34(28)40(31)43-38;1-41(2,33-22-18-29(19-23-33)37-24-20-30-16-14-27-8-3-5-12-35(27)39(30)42-37)34-11-7-10-32(26-34)38-25-21-31-17-15-28-9-4-6-13-36(28)40(31)43-38;2*1-3-10-33-25(6-1)12-14-28-18-22-35(39-37(28)33)27-16-20-31(21-17-27)41-32-9-5-8-30(24-32)36-23-19-29-15-13-26-7-2-4-11-34(26)38(29)40-36/h1-4,7-26H,5-6,27-28H2;2*3-26H,1-2H3;2*1-24H
• InChIKey: GAIYMYCSXPZIDD-UHFFFAOYSA-N
• XLogP: 53.57
• TPSA: 138.13 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 20
• Heavy Atoms: 213
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2743.47
LogP ≤ 5	53.57
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline?

The IUPAC name of 2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline (CID 158196122) is 2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline.

What is the SMILES notation for 2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline?

The canonical SMILES for 2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline is CC(C)(c1ccc(-c2ccc3ccc4ccccc4c3n2)cc1)c1cccc(-c2ccc3ccc4ccccc4c3n2)c1.CC(C)(c1ccc(-c2ccc3ccc4ccccc4c3n2)cc1)c1ccccc1-c1ccc2ccc3ccccc3c2n1.c1cc(Oc2ccc(-c3ccc4ccc5ccccc5c4n3)cc2)cc(-c2ccc3ccc4ccccc4c3n2)c1.c1cc(Sc2ccc(-c3ccc4ccc5ccccc5c4n3)cc2)cc(-c2ccc3ccc4ccccc4c3n2)c1.c1ccc2c(c1)ccc1ccc(-c3ccc(C4(c5ccc(-c6ccc7ccc8ccccc8c7n6)cc5)CCCC4)cc3)nc12.

What is the InChIKey of 2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline?

The InChIKey is GAIYMYCSXPZIDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H32N2.2C41H30N2.C38H24N2O.C38H24N2S/c1-3-9-37-29(7-1)11-13-33-19-25-39(44-41(33)37)31-15-21-35(22-16-31)43(27-5-6-28-43)36-23-17-32(18-24-36)40-26-20-34-14-12-30-8-2-4-10-38(30)42(34)45-40;1-41(2,32-23-19-29(20-24-32)37-25-21-30-17-15-27-9-3-5-11-33(27)39(30)42-37)36-14-8-7-13-35(36)38-26-22-31-18-16-28-10-4-6-12-34(28)40(31)43-38;1-41(2,33-22-18-29(19-23-33)37-24-20-30-16-14-27-8-3-5-12-35(27)39(30)42-37)34-11-7-10-32(26-34)38-25-21-31-17-15-28-9-4-6-13-36(28)40(31)43-38;2*1-3-10-33-25(6-1)12-14-28-18-22-35(39-37(28)33)27-16-20-31(21-17-27)41-32-9-5-8-30(24-32)36-23-19-29-15-13-26-7-2-4-11-34(26)38(29)40-36/h1-4,7-26H,5-6,27-28H2;2*3-26H,1-2H3;2*1-24H.

What are the key properties of 2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline?

2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline has a molecular weight of 2743.47 g/mol, XLogP of 53.57, 20 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-(4-benzo[h]quinolin-2-ylphenoxy)phenyl]benzo[h]quinoline;2-[4-[1-(4-benzo[h]quinolin-2-ylphenyl)cyclopentyl]phenyl]benzo[h]quinoline;2-[2-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-[2-(4-benzo[h]quinolin-2-ylphenyl)propan-2-yl]phenyl]benzo[h]quinoline;2-[3-(4-benzo[h]quinolin-2-ylphenyl)sulfanylphenyl]benzo[h]quinoline is sourced from PubChem (CID 158196122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).