9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine

C189H133N8O5P3S — CID 157468950

IUPAC9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine
SMILESCC1(C)c2ccccc2N(c2ccccc2)c2ccc(C3(c4ccc(S(=O)(=O)c5cccnc5)cc4)c4ccccc4-c4ccccc43)cc21.O=P(c1ccccc1)(c1ccccc1)c1ccc(C2(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc3-c3cccnc32)cc1.O=P(c1ccccc1)(c1ccccc1)c1ccc(C2(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc3-c3cccnc32)cc1.O=P(c1ccccc1)(c1ccccc1)c1ccc(C2(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc3-c3cnccc32)cc1
InChIInChI=1S/3C48H33N2OP.C45H34N2O2S/c2*51-52(37-17-6-2-7-18-37,38-19-8-3-9-20-38)39-29-26-34(27-30-39)48(44-24-12-10-21-40(44)42-23-14-32-49-47(42)48)35-28-31-46-43(33-35)41-22-11-13-25-45(41)50(46)36-15-4-1-5-16-36;51-52(37-16-6-2-7-17-37,38-18-8-3-9-19-38)39-27-24-34(25-28-39)48(44-22-12-10-20-40(44)43-33-49-31-30-45(43)48)35-26-29-47-42(32-35)41-21-11-13-23-46(41)50(47)36-14-4-1-5-15-36;1-44(2)40-20-10-11-21-42(40)47(33-13-4-3-5-14-33)43-27-24-32(29-41(43)44)45(38-18-8-6-16-36(38)37-17-7-9-19-39(37)45)31-22-25-34(26-23-31)50(48,49)35-15-12-28-46-30-35/h3*1-33H;3-30H,1-2H3
InChIKeyBUULTPZOOAFADB-UHFFFAOYSA-N
MW2721.18 g/mol
LogP40.93
Rot. Bonds23

About 9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine

9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine (PubChem CID 157468950) has the molecular formula C189H133N8O5P3S and a molecular weight of 2721.18 g/mol. Its IUPAC name is 9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine.

Molecular Properties

Compound Name9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine
PubChem CID157468950
Molecular FormulaC189H133N8O5P3S
Molecular Weight2721.18 g/mol
Exact Mass2718.93
IUPAC Name9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine
SMILESCC1(C)c2ccccc2N(c2ccccc2)c2ccc(C3(c4ccc(S(=O)(=O)c5cccnc5)cc4)c4ccccc4-c4ccccc43)cc21.O=P(c1ccccc1)(c1ccccc1)c1ccc(C2(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc3-c3cccnc32)cc1.O=P(c1ccccc1)(c1ccccc1)c1ccc(C2(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc3-c3cccnc32)cc1.O=P(c1ccccc1)(c1ccccc1)c1ccc(C2(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc3-c3cnccc32)cc1
InChIInChI=1S/3C48H33N2OP.C45H34N2O2S/c2*51-52(37-17-6-2-7-18-37,38-19-8-3-9-20-38)39-29-26-34(27-30-39)48(44-24-12-10-21-40(44)42-23-14-32-49-47(42)48)35-28-31-46-43(33-35)41-22-11-13-25-45(41)50(46)36-15-4-1-5-16-36;51-52(37-16-6-2-7-17-37,38-18-8-3-9-19-38)39-27-24-34(25-28-39)48(44-22-12-10-20-40(44)43-33-49-31-30-45(43)48)35-26-29-47-42(32-35)41-21-11-13-23-46(41)50(47)36-14-4-1-5-15-36;1-44(2)40-20-10-11-21-42(40)47(33-13-4-3-5-14-33)43-27-24-32(29-41(43)44)45(38-18-8-6-16-36(38)37-17-7-9-19-39(37)45)31-22-25-34(26-23-31)50(48,49)35-15-12-28-46-30-35/h3*1-33H;3-30H,1-2H3
InChIKeyBUULTPZOOAFADB-UHFFFAOYSA-N
XLogP40.93
TPSA154.94 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds23
Heavy Atoms206
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002721.18
LogP ≤ 540.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

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

Analyze 9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine with MolForge

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Related Compounds

2-[5-[4-(benzenesulfonyl)phenyl]indeno[1,2-c]pyridin-5-yl]-9,9-dimethyl-10-phenylacridine
CID 155273596
9,9-dimethyl-10-phenyl-2,7-bis(9-pyridin-3-ylfluoren-9-yl)acridine
CID 140899053
10-(9,9-dimethylfluoren-2-yl)-9-phenyl-9-(9-phenylcarbazol-3-yl)acridine
CID 146511336
2',7'-bis(9,9-dimethylacridin-10-yl)-10'-phenylspiro[6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-acridine];2',7'-di(carbazol-9-yl)-10'-phenylspiro[6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-acridine];2'-(9,9-dimethylacridin-10-yl)-10'-phenylspiro[6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-acridine];10-(7'-phenoxazin-10-yl-10'-phenylspiro[6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-acridine]-2'-yl)phenoxazine
CID 160667766
10-(9,9-dimethyl-10-phenylacridin-2-yl)-10-phenylanthracen-9-one
CID 140898964
9,9-dimethyl-10-[9-[2-methyl-4-[phenyl(pyridin-2-yl)phosphoryl]phenyl]carbazol-3-yl]acridine
CID 134194146
9-(9,9-dimethylfluoren-1-yl)-9-phenyl-10-(9-phenylcarbazol-3-yl)acridine
CID 153463090
10-[3-(9,9-dimethylacridin-10-yl)-5-[phenyl(pyridin-3-yl)phosphoryl]phenyl]-9,9-dimethylacridine
CID 134194182
9-phenyl-9-(9-phenylcarbazol-3-yl)-10-[4-(9-phenylcarbazol-3-yl)phenyl]acridine
CID 146511276
2-[4-(benzenesulfonyl)phenyl]-7-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-phenylacridine
CID 134579034
10,10,21,21-tetramethyl-14-(9-phenylcarbazol-3-yl)-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 130450658
3-carbazol-9-yl-9-diphenylphosphorylcarbazole;2-carbazol-9-yl-10-diphenylphosphoryl-9,9-dimethylacridine;10-(9-diphenylphosphorylcarbazol-3-yl)-9,9-diphenylacridine
CID 161223597

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine?
The IUPAC name of 9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine (CID 157468950) is 9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine.
What is the SMILES notation for 9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine?
The canonical SMILES for 9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine is CC1(C)c2ccccc2N(c2ccccc2)c2ccc(C3(c4ccc(S(=O)(=O)c5cccnc5)cc4)c4ccccc4-c4ccccc43)cc21.O=P(c1ccccc1)(c1ccccc1)c1ccc(C2(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc3-c3cccnc32)cc1.O=P(c1ccccc1)(c1ccccc1)c1ccc(C2(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc3-c3cccnc32)cc1.O=P(c1ccccc1)(c1ccccc1)c1ccc(C2(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc3-c3cnccc32)cc1.
What is the InChIKey of 9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine?
The InChIKey is BUULTPZOOAFADB-UHFFFAOYSA-N. The full InChI is InChI=1S/3C48H33N2OP.C45H34N2O2S/c2*51-52(37-17-6-2-7-18-37,38-19-8-3-9-20-38)39-29-26-34(27-30-39)48(44-24-12-10-21-40(44)42-23-14-32-49-47(42)48)35-28-31-46-43(33-35)41-22-11-13-25-45(41)50(46)36-15-4-1-5-16-36;51-52(37-16-6-2-7-17-37,38-18-8-3-9-19-38)39-27-24-34(25-28-39)48(44-22-12-10-20-40(44)43-33-49-31-30-45(43)48)35-26-29-47-42(32-35)41-21-11-13-23-46(41)50(47)36-14-4-1-5-15-36;1-44(2)40-20-10-11-21-42(40)47(33-13-4-3-5-14-33)43-27-24-32(29-41(43)44)45(38-18-8-6-16-36(38)37-17-7-9-19-39(37)45)31-22-25-34(26-23-31)50(48,49)35-15-12-28-46-30-35/h3*1-33H;3-30H,1-2H3.
What are the key properties of 9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine?
9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine has a molecular weight of 2721.18 g/mol, XLogP of 40.93, 23 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-10-phenyl-2-[9-(4-pyridin-3-ylsulfonylphenyl)fluoren-9-yl]acridine;bis(9-(4-diphenylphosphorylphenyl)-9-(9-phenylcarbazol-3-yl)indeno[2,1-b]pyridine);5-(4-diphenylphosphorylphenyl)-5-(9-phenylcarbazol-3-yl)indeno[1,2-c]pyridine is sourced from PubChem (CID 157468950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).