9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine

C41H28N4 — CID 138641305

IUPAC9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3N(c3ccc(-n4c5ccccc5c5ncccc54)cn3)c3ccccc32)cc1
InChIInChI=1S/C41H28N4/c1-3-14-29(15-4-1)41(30-16-5-2-6-17-30)33-19-8-11-22-36(33)45(37-23-12-9-20-34(37)41)39-26-25-31(28-43-39)44-35-21-10-7-18-32(35)40-38(44)24-13-27-42-40/h1-28H
InChIKeyPJHQFJZYQHYIJA-UHFFFAOYSA-N
MW576.70 g/mol
LogP9.74
Rot. Bonds4

About 9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine

9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine (PubChem CID 138641305) has the molecular formula C41H28N4 and a molecular weight of 576.70 g/mol. Its IUPAC name is 9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine.

Molecular Properties

Compound Name9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine
PubChem CID138641305
Molecular FormulaC41H28N4
Molecular Weight576.70 g/mol
Exact Mass576.23
IUPAC Name9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3N(c3ccc(-n4c5ccccc5c5ncccc54)cn3)c3ccccc32)cc1
InChIInChI=1S/C41H28N4/c1-3-14-29(15-4-1)41(30-16-5-2-6-17-30)33-19-8-11-22-36(33)45(37-23-12-9-20-34(37)41)39-26-25-31(28-43-39)44-35-21-10-7-18-32(35)40-38(44)24-13-27-42-40/h1-28H
InChIKeyPJHQFJZYQHYIJA-UHFFFAOYSA-N
XLogP9.74
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500576.70
LogP ≤ 59.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

10-phenyl-10'-(5-pyridin-4-ylpyrido[3,2-b]indol-8-yl)-9,9'-spirobi[acridine]
CID 139574635
10-(5-pyridin-3-ylpyrido[3,2-b]indol-8-yl)spiro[acridine-9,9'-fluorene]
CID 138641297
10-phenyl-10'-(8-pyridin-3-yl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl)-9,9'-spirobi[acridine]
CID 139574637
5-phenyl-5'-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)-10,10'-spirobi[benzo[b][1,4]benzazasiline];5-phenyl-5'-(5-pyrido[3,4-b]indol-9-yl-2-pyridinyl)-10,10'-spirobi[benzo[b][1,4]benzazasiline];5-phenyl-5'-(5-pyrido[4,3-b]indol-5-yl-2-pyridinyl)-10,10'-spirobi[benzo[b][1,4]benzazasiline]
CID 159513500
10-[4,6-di(carbazol-9-yl)-2-pyridinyl]-5,5-diphenylbenzo[b][1,7]naphthyridine
CID 154589746
10-[4,6-bis(3-carbazol-9-ylcarbazol-9-yl)-2-pyridinyl]-5,5-diphenylbenzo[b][1,7]naphthyridine
CID 154589727
5-pyridin-3-ylpyrido[3,2-b]indole
CID 59459758
9,9-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)acridine
CID 138641354
5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole
CID 147682919
20,20-diphenyl-10-[4-(9-phenylcarbazol-3-yl)phenyl]-5,10-diazapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14,16,18-nonaene
CID 71037087
5-phenyl-8-[3-(9-phenylfluoren-9-yl)phenyl]pyrido[3,2-b]indole
CID 149073025
10-[4-(9,9-diphenylacridin-10-yl)phenyl]-9,9-diphenylacridine
CID 59399598

Frequently Asked Questions

What is the IUPAC name of 9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine?
The IUPAC name of 9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine (CID 138641305) is 9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine.
What is the SMILES notation for 9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine?
The canonical SMILES for 9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine is c1ccc(C2(c3ccccc3)c3ccccc3N(c3ccc(-n4c5ccccc5c5ncccc54)cn3)c3ccccc32)cc1.
What is the InChIKey of 9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine?
The InChIKey is PJHQFJZYQHYIJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H28N4/c1-3-14-29(15-4-1)41(30-16-5-2-6-17-30)33-19-8-11-22-36(33)45(37-23-12-9-20-34(37)41)39-26-25-31(28-43-39)44-35-21-10-7-18-32(35)40-38(44)24-13-27-42-40/h1-28H.
What are the key properties of 9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine?
9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine has a molecular weight of 576.70 g/mol, XLogP of 9.74, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-diphenyl-10-(5-pyrido[3,2-b]indol-5-yl-2-pyridinyl)acridine is sourced from PubChem (CID 138641305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).