9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine

C166H116N12O10S5 — CID 157269764

IUPAC9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine
SMILESCC1(C)c2ccccc2N(c2cccc(-c3cccc(S(=O)(=O)c4ccccc4)n3)c2)c2ccccc21.O=S(=O)(c1ccccc1)c1cc(-n2c3ccccc3c3ccccc32)nc(-n2c3ccccc3c3ccccc32)c1.O=S(=O)(c1ccccc1)c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cn1.O=S(=O)(c1ccccc1)c1cccc(-c2cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c2)n1.O=S(=O)(c1ccccc1)c1cccc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)n1
InChIInChI=1S/C41H27N3O2S.C35H23N3O2S.C32H26N2O2S.2C29H20N2O2S/c45-47(46,31-13-2-1-3-14-31)41-24-12-19-36(42-41)28-25-29(43-37-20-8-4-15-32(37)33-16-5-9-21-38(33)43)27-30(26-28)44-39-22-10-6-17-34(39)35-18-7-11-23-40(35)44;39-41(40,24-12-2-1-3-13-24)25-22-34(37-30-18-8-4-14-26(30)27-15-5-9-19-31(27)37)36-35(23-25)38-32-20-10-6-16-28(32)29-17-7-11-21-33(29)38;1-32(2)26-16-6-8-19-29(26)34(30-20-9-7-17-27(30)32)24-13-10-12-23(22-24)28-18-11-21-31(33-28)37(35,36)25-14-4-3-5-15-25;32-34(33,24-11-5-2-6-12-24)29-18-16-22(20-30-29)21-15-17-28-26(19-21)25-13-7-8-14-27(25)31(28)23-9-3-1-4-10-23;32-34(33,23-12-2-1-3-13-23)29-19-9-16-26(30-29)21-10-8-11-22(20-21)31-27-17-6-4-14-24(27)25-15-5-7-18-28(25)31/h1-27H;1-23H;3-22H,1-2H3;2*1-20H
InChIKeyAYKBFKQJBWJYDY-UHFFFAOYSA-N
MW2599.16 g/mol
LogP38.93
Rot. Bonds21

About 9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine

9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine (PubChem CID 157269764) has the molecular formula C166H116N12O10S5 and a molecular weight of 2599.16 g/mol. Its IUPAC name is 9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine.

Molecular Properties

Compound Name9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine
PubChem CID157269764
Molecular FormulaC166H116N12O10S5
Molecular Weight2599.16 g/mol
Exact Mass2596.75
IUPAC Name9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine
SMILESCC1(C)c2ccccc2N(c2cccc(-c3cccc(S(=O)(=O)c4ccccc4)n3)c2)c2ccccc21.O=S(=O)(c1ccccc1)c1cc(-n2c3ccccc3c3ccccc32)nc(-n2c3ccccc3c3ccccc32)c1.O=S(=O)(c1ccccc1)c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cn1.O=S(=O)(c1ccccc1)c1cccc(-c2cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c2)n1.O=S(=O)(c1ccccc1)c1cccc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)n1
InChIInChI=1S/C41H27N3O2S.C35H23N3O2S.C32H26N2O2S.2C29H20N2O2S/c45-47(46,31-13-2-1-3-14-31)41-24-12-19-36(42-41)28-25-29(43-37-20-8-4-15-32(37)33-16-5-9-21-38(33)43)27-30(26-28)44-39-22-10-6-17-34(39)35-18-7-11-23-40(35)44;39-41(40,24-12-2-1-3-13-24)25-22-34(37-30-18-8-4-14-26(30)27-15-5-9-19-31(27)37)36-35(23-25)38-32-20-10-6-16-28(32)29-17-7-11-21-33(29)38;1-32(2)26-16-6-8-19-29(26)34(30-20-9-7-17-27(30)32)24-13-10-12-23(22-24)28-18-11-21-31(33-28)37(35,36)25-14-4-3-5-15-25;32-34(33,24-11-5-2-6-12-24)29-18-16-22(20-30-29)21-15-17-28-26(19-21)25-13-7-8-14-27(25)31(28)23-9-3-1-4-10-23;32-34(33,23-12-2-1-3-13-23)29-19-9-16-26(30-29)21-10-8-11-22(20-21)31-27-17-6-4-14-24(27)25-15-5-7-18-28(25)31/h1-27H;1-23H;3-22H,1-2H3;2*1-20H
InChIKeyAYKBFKQJBWJYDY-UHFFFAOYSA-N
XLogP38.93
TPSA267.97 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds21
Heavy Atoms193
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002599.16
LogP ≤ 538.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze 9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine?
The IUPAC name of 9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine (CID 157269764) is 9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine.
What is the SMILES notation for 9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine?
The canonical SMILES for 9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine is CC1(C)c2ccccc2N(c2cccc(-c3cccc(S(=O)(=O)c4ccccc4)n3)c2)c2ccccc21.O=S(=O)(c1ccccc1)c1cc(-n2c3ccccc3c3ccccc32)nc(-n2c3ccccc3c3ccccc32)c1.O=S(=O)(c1ccccc1)c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cn1.O=S(=O)(c1ccccc1)c1cccc(-c2cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c2)n1.O=S(=O)(c1ccccc1)c1cccc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)n1.
What is the InChIKey of 9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine?
The InChIKey is AYKBFKQJBWJYDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H27N3O2S.C35H23N3O2S.C32H26N2O2S.2C29H20N2O2S/c45-47(46,31-13-2-1-3-14-31)41-24-12-19-36(42-41)28-25-29(43-37-20-8-4-15-32(37)33-16-5-9-21-38(33)43)27-30(26-28)44-39-22-10-6-17-34(39)35-18-7-11-23-40(35)44;39-41(40,24-12-2-1-3-13-24)25-22-34(37-30-18-8-4-14-26(30)27-15-5-9-19-31(27)37)36-35(23-25)38-32-20-10-6-16-28(32)29-17-7-11-21-33(29)38;1-32(2)26-16-6-8-19-29(26)34(30-20-9-7-17-27(30)32)24-13-10-12-23(22-24)28-18-11-21-31(33-28)37(35,36)25-14-4-3-5-15-25;32-34(33,24-11-5-2-6-12-24)29-18-16-22(20-30-29)21-15-17-28-26(19-21)25-13-7-8-14-27(25)31(28)23-9-3-1-4-10-23;32-34(33,23-12-2-1-3-13-23)29-19-9-16-26(30-29)21-10-8-11-22(20-21)31-27-17-6-4-14-24(27)25-15-5-7-18-28(25)31/h1-27H;1-23H;3-22H,1-2H3;2*1-20H.
What are the key properties of 9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine?
9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine has a molecular weight of 2599.16 g/mol, XLogP of 38.93, 21 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(benzenesulfonyl)-6-carbazol-9-yl-2-pyridinyl]carbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]-5-carbazol-9-ylphenyl]carbazole;3-[6-(benzenesulfonyl)-3-pyridinyl]-9-phenylcarbazole;9-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]carbazole;10-[3-[6-(benzenesulfonyl)-2-pyridinyl]phenyl]-9,9-dimethylacridine is sourced from PubChem (CID 157269764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).