2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene

C295H244F4O30S5 — CID 159947826

IUPAC2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene
SMILESCc1ccc(C(=O)c2ccc(Oc3ccc(C(F)(F)c4ccc(Oc5ccc(C(=O)c6ccc(C)cc6)cc5)cc4)cc3)cc2)cc1.Cc1ccc(C)c(C(=O)c2ccc(-c3ccccc3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3ccc(-c4ccccc4)cc3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3ccc(Oc4ccccc4)cc3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3ccc4ccccc4c3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3cccc4ccccc34)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3ccccc3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccccc2)c1.Cc1ccc(C)c(S(=O)(=O)c2ccc(-c3ccccc3)cc2)c1.Cc1ccc(C)c(S(=O)(=O)c2ccc(Oc3ccccc3)cc2)c1.Cc1ccc(C)c(S(=O)(=O)c2ccccc2)c1.Cc1ccc(S(=O)(=O)c2ccc(Oc3ccc(C(F)(F)c4ccc(Oc5ccc(S(=O)(=O)c6ccc(C)cc6)cc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C41H30F2O4.C39H30F2O6S2.C27H22O3.C27H22O2.2C25H20O2.C21H18O2.C21H18O.C20H18O3S.C20H18O2S.C15H14O.C14H14O2S/c1-27-3-7-29(8-4-27)39(44)31-11-19-35(20-12-31)46-37-23-15-33(16-24-37)41(42,43)34-17-25-38(26-18-34)47-36-21-13-32(14-22-36)40(45)30-9-5-28(2)6-10-30;1-27-3-19-35(20-4-27)48(42,43)37-23-15-33(16-24-37)46-31-11-7-29(8-12-31)39(40,41)30-9-13-32(14-10-30)47-34-17-25-38(26-18-34)49(44,45)36-21-5-28(2)6-22-36;1-19-8-9-20(2)26(18-19)27(28)21-10-12-23(13-11-21)30-25-16-14-24(15-17-25)29-22-6-4-3-5-7-22;1-19-8-9-20(2)26(18-19)27(28)23-12-16-25(17-13-23)29-24-14-10-22(11-15-24)21-6-4-3-5-7-21;1-17-10-11-18(2)23(16-17)25(26)20-12-14-21(15-13-20)27-24-9-5-7-19-6-3-4-8-22(19)24;1-17-7-8-18(2)24(15-17)25(26)20-10-12-22(13-11-20)27-23-14-9-19-5-3-4-6-21(19)16-23;1-15-8-9-16(2)20(14-15)21(22)17-10-12-19(13-11-17)23-18-6-4-3-5-7-18;1-15-8-9-16(2)20(14-15)21(22)19-12-10-18(11-13-19)17-6-4-3-5-7-17;1-15-8-9-16(2)20(14-15)24(21,22)19-12-10-18(11-13-19)23-17-6-4-3-5-7-17;1-15-8-9-16(2)20(14-15)23(21,22)19-12-10-18(11-13-19)17-6-4-3-5-7-17;1-11-8-9-12(2)14(10-11)15(16)13-6-4-3-5-7-13;1-11-8-9-12(2)14(10-11)17(15,16)13-6-4-3-5-7-13/h3-26H,1-2H3;3-26H,1-2H3;3-18H,1-2H3;3-18H,1-2H3;2*3-16H,1-2H3;3-14H,1-2H3;3-14H,1-2H3;3-14H,1-2H3;3-14H,1-2H3;3-10H,1-2H3;3-10H,1-2H3
InChIKeyOBSGXZJZGDPCOL-UHFFFAOYSA-N
MW4505.49 g/mol
LogP74.19
Rot. Bonds57

About 2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene

2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene (PubChem CID 159947826) has the molecular formula C295H244F4O30S5 and a molecular weight of 4505.49 g/mol. Its IUPAC name is 2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene.

Molecular Properties

Compound Name2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene
PubChem CID159947826
Molecular FormulaC295H244F4O30S5
Molecular Weight4505.49 g/mol
Exact Mass4501.61
IUPAC Name2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene
SMILESCc1ccc(C(=O)c2ccc(Oc3ccc(C(F)(F)c4ccc(Oc5ccc(C(=O)c6ccc(C)cc6)cc5)cc4)cc3)cc2)cc1.Cc1ccc(C)c(C(=O)c2ccc(-c3ccccc3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3ccc(-c4ccccc4)cc3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3ccc(Oc4ccccc4)cc3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3ccc4ccccc4c3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3cccc4ccccc34)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3ccccc3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccccc2)c1.Cc1ccc(C)c(S(=O)(=O)c2ccc(-c3ccccc3)cc2)c1.Cc1ccc(C)c(S(=O)(=O)c2ccc(Oc3ccccc3)cc2)c1.Cc1ccc(C)c(S(=O)(=O)c2ccccc2)c1.Cc1ccc(S(=O)(=O)c2ccc(Oc3ccc(C(F)(F)c4ccc(Oc5ccc(S(=O)(=O)c6ccc(C)cc6)cc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C41H30F2O4.C39H30F2O6S2.C27H22O3.C27H22O2.2C25H20O2.C21H18O2.C21H18O.C20H18O3S.C20H18O2S.C15H14O.C14H14O2S/c1-27-3-7-29(8-4-27)39(44)31-11-19-35(20-12-31)46-37-23-15-33(16-24-37)41(42,43)34-17-25-38(26-18-34)47-36-21-13-32(14-22-36)40(45)30-9-5-28(2)6-10-30;1-27-3-19-35(20-4-27)48(42,43)37-23-15-33(16-24-37)46-31-11-7-29(8-12-31)39(40,41)30-9-13-32(14-10-30)47-34-17-25-38(26-18-34)49(44,45)36-21-5-28(2)6-22-36;1-19-8-9-20(2)26(18-19)27(28)21-10-12-23(13-11-21)30-25-16-14-24(15-17-25)29-22-6-4-3-5-7-22;1-19-8-9-20(2)26(18-19)27(28)23-12-16-25(17-13-23)29-24-14-10-22(11-15-24)21-6-4-3-5-7-21;1-17-10-11-18(2)23(16-17)25(26)20-12-14-21(15-13-20)27-24-9-5-7-19-6-3-4-8-22(19)24;1-17-7-8-18(2)24(15-17)25(26)20-10-12-22(13-11-20)27-23-14-9-19-5-3-4-6-21(19)16-23;1-15-8-9-16(2)20(14-15)21(22)17-10-12-19(13-11-17)23-18-6-4-3-5-7-18;1-15-8-9-16(2)20(14-15)21(22)19-12-10-18(11-13-19)17-6-4-3-5-7-17;1-15-8-9-16(2)20(14-15)24(21,22)19-12-10-18(11-13-19)23-17-6-4-3-5-7-17;1-15-8-9-16(2)20(14-15)23(21,22)19-12-10-18(11-13-19)17-6-4-3-5-7-17;1-11-8-9-12(2)14(10-11)15(16)13-6-4-3-5-7-13;1-11-8-9-12(2)14(10-11)17(15,16)13-6-4-3-5-7-13/h3-26H,1-2H3;3-26H,1-2H3;3-18H,1-2H3;3-18H,1-2H3;2*3-16H,1-2H3;3-14H,1-2H3;3-14H,1-2H3;3-14H,1-2H3;3-14H,1-2H3;3-10H,1-2H3;3-10H,1-2H3
InChIKeyOBSGXZJZGDPCOL-UHFFFAOYSA-N
XLogP74.19
TPSA425.86 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds57
Heavy Atoms334
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004505.49
LogP ≤ 574.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze 2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene with MolForge

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Related Compounds

[2-Methoxycarbonyl-4-[(2-methylpropan-2-yl)oxy]naphthalen-1-yl]-diphenylsulfanium;trifluoromethanesulfonate
CID 18688734
[4-[4-[1,1,1,3,3,3-Hexafluoro-2-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-(4-methylphenyl)methanone
CID 57737974
4-[5-Methoxy-2-[4-[4-[4-[4-(4-methylbenzoyl)phenoxy]-3-[3-methyl-5-(trifluoromethyl)phenyl]phenoxy]benzoyl]phenoxy]phenyl]-2-methylbenzenesulfonic acid
CID 57822735
[5-[4-[4-(4-Methoxyphenyl)phenoxy]-3-methoxysulfonylbenzoyl]-2-[4-[4-[2,3,5,6-tetrafluoro-4-(2,3,5,6-tetrafluoro-4-methylphenyl)sulfonylphenoxy]phenyl]phenoxy]phenyl]methanesulfonic acid
CID 58185893
[4-[4-[1,1,1,3,3,3-Hexafluoro-2-[4-[4-[4-[4-methyl-3-[3-(trioxidanylsulfanyl)phenyl]sulfonylphenyl]benzoyl]phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-(4-methylphenyl)methanone
CID 58658211
[4-(4-Methylphenyl)phenyl]-[4-[4-(2,3,5,6-tetrafluoro-4-methylphenyl)sulfonylphenoxy]phenyl]methanone
CID 58690157
3-[4-[5-[4-[4-[4-[1,1,1,3,3,3-Hexafluoro-2-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]propan-2-yl]phenoxy]benzoyl]phenyl]-2-methylbenzoyl]phenyl]sulfanylpropane-1-sulfonic acid
CID 58693264
[4-[4-[1,1,1,3,3,3-Hexafluoro-2-[4-[4-[4-[4-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[4-[4-[4-methyl-3-[3-(trioxidanylsulfanyl)benzoyl]phenyl]benzoyl]phenoxy]phenyl]propan-2-yl]phenoxy]butyl]phenyl]sulfonylphenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-(4-methylphenyl)methanone
CID 58769498
6-[4-[5-[4-[4-[4-[1,1,1,3,3,3-Hexafluoro-2-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]propan-2-yl]phenoxy]benzoyl]phenyl]-2-methylbenzoyl]phenoxy]-4-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid
CID 58769499
2-[3-[4-[6,8-Bis[dihydroxy-(2-methylbutyl)-oxo-lambda6-sulfanyl]naphthalen-2-yl]oxy-3-(3-methylpentyl)benzoyl]-4-(2-cyano-3-fluorophenyl)phenyl]-6-fluorobenzonitrile
CID 58769514
2-[3-[4-[6,8-Bis(butyl-dihydroxy-oxo-lambda6-sulfanyl)naphthalen-2-yl]oxy-3-pentylbenzoyl]-4-(2-cyano-3-fluorophenyl)phenyl]-6-fluorobenzonitrile
CID 58769526
2-[3-[4-[6,8-Bis(tert-butyl-dihydroxy-oxo-lambda6-sulfanyl)naphthalen-2-yl]oxy-3-(2,2-dimethylpropyl)benzoyl]-4-(2-cyano-3-fluorophenyl)phenyl]-6-fluorobenzonitrile
CID 58769550

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene?
The IUPAC name of 2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene (CID 159947826) is 2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene.
What is the SMILES notation for 2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene?
The canonical SMILES for 2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene is Cc1ccc(C(=O)c2ccc(Oc3ccc(C(F)(F)c4ccc(Oc5ccc(C(=O)c6ccc(C)cc6)cc5)cc4)cc3)cc2)cc1.Cc1ccc(C)c(C(=O)c2ccc(-c3ccccc3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3ccc(-c4ccccc4)cc3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3ccc(Oc4ccccc4)cc3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3ccc4ccccc4c3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3cccc4ccccc34)cc2)c1.Cc1ccc(C)c(C(=O)c2ccc(Oc3ccccc3)cc2)c1.Cc1ccc(C)c(C(=O)c2ccccc2)c1.Cc1ccc(C)c(S(=O)(=O)c2ccc(-c3ccccc3)cc2)c1.Cc1ccc(C)c(S(=O)(=O)c2ccc(Oc3ccccc3)cc2)c1.Cc1ccc(C)c(S(=O)(=O)c2ccccc2)c1.Cc1ccc(S(=O)(=O)c2ccc(Oc3ccc(C(F)(F)c4ccc(Oc5ccc(S(=O)(=O)c6ccc(C)cc6)cc5)cc4)cc3)cc2)cc1.
What is the InChIKey of 2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene?
The InChIKey is OBSGXZJZGDPCOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H30F2O4.C39H30F2O6S2.C27H22O3.C27H22O2.2C25H20O2.C21H18O2.C21H18O.C20H18O3S.C20H18O2S.C15H14O.C14H14O2S/c1-27-3-7-29(8-4-27)39(44)31-11-19-35(20-12-31)46-37-23-15-33(16-24-37)41(42,43)34-17-25-38(26-18-34)47-36-21-13-32(14-22-36)40(45)30-9-5-28(2)6-10-30;1-27-3-19-35(20-4-27)48(42,43)37-23-15-33(16-24-37)46-31-11-7-29(8-12-31)39(40,41)30-9-13-32(14-10-30)47-34-17-25-38(26-18-34)49(44,45)36-21-5-28(2)6-22-36;1-19-8-9-20(2)26(18-19)27(28)21-10-12-23(13-11-21)30-25-16-14-24(15-17-25)29-22-6-4-3-5-7-22;1-19-8-9-20(2)26(18-19)27(28)23-12-16-25(17-13-23)29-24-14-10-22(11-15-24)21-6-4-3-5-7-21;1-17-10-11-18(2)23(16-17)25(26)20-12-14-21(15-13-20)27-24-9-5-7-19-6-3-4-8-22(19)24;1-17-7-8-18(2)24(15-17)25(26)20-10-12-22(13-11-20)27-23-14-9-19-5-3-4-6-21(19)16-23;1-15-8-9-16(2)20(14-15)21(22)17-10-12-19(13-11-17)23-18-6-4-3-5-7-18;1-15-8-9-16(2)20(14-15)21(22)19-12-10-18(11-13-19)17-6-4-3-5-7-17;1-15-8-9-16(2)20(14-15)24(21,22)19-12-10-18(11-13-19)23-17-6-4-3-5-7-17;1-15-8-9-16(2)20(14-15)23(21,22)19-12-10-18(11-13-19)17-6-4-3-5-7-17;1-11-8-9-12(2)14(10-11)15(16)13-6-4-3-5-7-13;1-11-8-9-12(2)14(10-11)17(15,16)13-6-4-3-5-7-13/h3-26H,1-2H3;3-26H,1-2H3;3-18H,1-2H3;3-18H,1-2H3;2*3-16H,1-2H3;3-14H,1-2H3;3-14H,1-2H3;3-14H,1-2H3;3-14H,1-2H3;3-10H,1-2H3;3-10H,1-2H3.
What are the key properties of 2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene?
2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene has a molecular weight of 4505.49 g/mol, XLogP of 74.19, 57 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene is sourced from PubChem (CID 159947826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).