6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine

C134H106Br5N9O6S3 — CID 159501180

IUPAC6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine
SMILESCC1(C)c2cc(-n3c4ccccc4c4ccccc43)ccc2Nc2ccc(-n3c4ccccc4c4ccccc43)cc21.CC1(C)c2cc(Br)ccc2Nc2ccc(Br)cc21.Cc1ccc(S(=O)(=O)N2c3ccc(-n4c5ccccc5c5ccccc54)cc3C(C)(C)c3cc(-n4c5ccccc5c5ccccc54)ccc32)cc1.Cc1ccc(S(=O)(=O)N2c3ccc(Br)cc3C(C)(C)c3cc(Br)ccc32)cc1.Cc1nc(S(=O)(=O)c2ccccc2)ccc1Br
InChIInChI=1S/C46H35N3O2S.C39H29N3.C22H19Br2NO2S.C15H13Br2N.C12H10BrNO2S/c1-30-20-24-33(25-21-30)52(50,51)49-44-26-22-31(47-40-16-8-4-12-34(40)35-13-5-9-17-41(35)47)28-38(44)46(2,3)39-29-32(23-27-45(39)49)48-42-18-10-6-14-36(42)37-15-7-11-19-43(37)48;1-39(2)31-23-25(41-35-15-7-3-11-27(35)28-12-4-8-16-36(28)41)19-21-33(31)40-34-22-20-26(24-32(34)39)42-37-17-9-5-13-29(37)30-14-6-10-18-38(30)42;1-14-4-8-17(9-5-14)28(26,27)25-20-10-6-15(23)12-18(20)22(2,3)19-13-16(24)7-11-21(19)25;1-15(2)11-7-9(16)3-5-13(11)18-14-6-4-10(17)8-12(14)15;1-9-11(13)7-8-12(14-9)17(15,16)10-5-3-2-4-6-10/h4-29H,1-3H3;3-24,40H,1-2H3;4-13H,1-3H3;3-8,18H,1-2H3;2-8H,1H3
InChIKeyLZKAQDACXJLEPZ-UHFFFAOYSA-N
MW2434.10 g/mol
LogP36.89
Rot. Bonds10

About 6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine

6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine (PubChem CID 159501180) has the molecular formula C134H106Br5N9O6S3 and a molecular weight of 2434.10 g/mol. Its IUPAC name is 6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine.

Molecular Properties

Compound Name6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine
PubChem CID159501180
Molecular FormulaC134H106Br5N9O6S3
Molecular Weight2434.10 g/mol
Exact Mass2427.33
IUPAC Name6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine
SMILESCC1(C)c2cc(-n3c4ccccc4c4ccccc43)ccc2Nc2ccc(-n3c4ccccc4c4ccccc43)cc21.CC1(C)c2cc(Br)ccc2Nc2ccc(Br)cc21.Cc1ccc(S(=O)(=O)N2c3ccc(-n4c5ccccc5c5ccccc54)cc3C(C)(C)c3cc(-n4c5ccccc5c5ccccc54)ccc32)cc1.Cc1ccc(S(=O)(=O)N2c3ccc(Br)cc3C(C)(C)c3cc(Br)ccc32)cc1.Cc1nc(S(=O)(=O)c2ccccc2)ccc1Br
InChIInChI=1S/C46H35N3O2S.C39H29N3.C22H19Br2NO2S.C15H13Br2N.C12H10BrNO2S/c1-30-20-24-33(25-21-30)52(50,51)49-44-26-22-31(47-40-16-8-4-12-34(40)35-13-5-9-17-41(35)47)28-38(44)46(2,3)39-29-32(23-27-45(39)49)48-42-18-10-6-14-36(42)37-15-7-11-19-43(37)48;1-39(2)31-23-25(41-35-15-7-3-11-27(35)28-12-4-8-16-36(28)41)19-21-33(31)40-34-22-20-26(24-32(34)39)42-37-17-9-5-13-29(37)30-14-6-10-18-38(30)42;1-14-4-8-17(9-5-14)28(26,27)25-20-10-6-15(23)12-18(20)22(2,3)19-13-16(24)7-11-21(19)25;1-15(2)11-7-9(16)3-5-13(11)18-14-6-4-10(17)8-12(14)15;1-9-11(13)7-8-12(14-9)17(15,16)10-5-3-2-4-6-10/h4-29H,1-3H3;3-24,40H,1-2H3;4-13H,1-3H3;3-8,18H,1-2H3;2-8H,1H3
InChIKeyLZKAQDACXJLEPZ-UHFFFAOYSA-N
XLogP36.89
TPSA165.57 Ų
H-Bond Donors2
H-Bond Acceptors13
Rotatable Bonds10
Heavy Atoms157
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002434.10
LogP ≤ 536.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1013

Analyze 6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine with MolForge

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Related Compounds

2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine
CID 134237381
5-bromo-3-(diiodomethyl)-1-(4-methylphenyl)sulfonyl-3-phenylindol-2-one
CID 102202490
2-carbazol-9-yl-10-diphenylphosphoryl-9,9-dimethylacridine
CID 140928513
3-(3-carbazol-9-ylcarbazol-9-yl)-9-[9-[9-(4-methylphenyl)sulfonylcarbazol-3-yl]carbazol-3-yl]carbazole
CID 24814813
3-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]-9-[9-[9-[9-(4-methylphenyl)sulfonylcarbazol-3-yl]carbazol-3-yl]carbazol-3-yl]carbazole
CID 25209134
9-(7-bromo-9,9,10,10-tetramethylanthracen-2-yl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 153445556
1-bromo-4-(4-bromophenyl)sulfonylbenzene;9-[4-[4-(4-bromophenyl)sulfonylphenyl]phenyl]carbazole;(4-carbazol-9-ylphenyl)boronic acid
CID 158167009
9-[4-(benzenesulfonyl)phenyl]carbazole
CID 132916142
10-diphenylphosphoryl-9,9-dimethyl-2-(3-phenylcarbazol-9-yl)acridine
CID 140928529
3-bromo-9-(9,9-dimethylfluoren-2-yl)carbazole
CID 89472048
9-[9-[4-[4-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]phenyl]sulfonylphenyl]carbazol-3-yl]-3-(3-methylcarbazol-9-yl)-6-phenylcarbazole
CID 121444321
(2-bromo-5-carbazol-9-ylphenyl)methyl 4-methylbenzenesulfonate
CID 156677149

Frequently Asked Questions

What is the IUPAC name of 6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine?
The IUPAC name of 6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine (CID 159501180) is 6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine.
What is the SMILES notation for 6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine?
The canonical SMILES for 6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine is CC1(C)c2cc(-n3c4ccccc4c4ccccc43)ccc2Nc2ccc(-n3c4ccccc4c4ccccc43)cc21.CC1(C)c2cc(Br)ccc2Nc2ccc(Br)cc21.Cc1ccc(S(=O)(=O)N2c3ccc(-n4c5ccccc5c5ccccc54)cc3C(C)(C)c3cc(-n4c5ccccc5c5ccccc54)ccc32)cc1.Cc1ccc(S(=O)(=O)N2c3ccc(Br)cc3C(C)(C)c3cc(Br)ccc32)cc1.Cc1nc(S(=O)(=O)c2ccccc2)ccc1Br.
What is the InChIKey of 6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine?
The InChIKey is LZKAQDACXJLEPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H35N3O2S.C39H29N3.C22H19Br2NO2S.C15H13Br2N.C12H10BrNO2S/c1-30-20-24-33(25-21-30)52(50,51)49-44-26-22-31(47-40-16-8-4-12-34(40)35-13-5-9-17-41(35)47)28-38(44)46(2,3)39-29-32(23-27-45(39)49)48-42-18-10-6-14-36(42)37-15-7-11-19-43(37)48;1-39(2)31-23-25(41-35-15-7-3-11-27(35)28-12-4-8-16-36(28)41)19-21-33(31)40-34-22-20-26(24-32(34)39)42-37-17-9-5-13-29(37)30-14-6-10-18-38(30)42;1-14-4-8-17(9-5-14)28(26,27)25-20-10-6-15(23)12-18(20)22(2,3)19-13-16(24)7-11-21(19)25;1-15(2)11-7-9(16)3-5-13(11)18-14-6-4-10(17)8-12(14)15;1-9-11(13)7-8-12(14-9)17(15,16)10-5-3-2-4-6-10/h4-29H,1-3H3;3-24,40H,1-2H3;4-13H,1-3H3;3-8,18H,1-2H3;2-8H,1H3.
What are the key properties of 6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine?
6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine has a molecular weight of 2434.10 g/mol, XLogP of 36.89, 10 rotatable bonds, 2 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(benzenesulfonyl)-3-bromo-2-methylpyridine;2,7-dibromo-9,9-dimethyl-10H-acridine;2,7-dibromo-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10H-acridine;2,7-di(carbazol-9-yl)-9,9-dimethyl-10-(4-methylphenyl)sulfonylacridine is sourced from PubChem (CID 159501180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).