4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol

C177H236O10S10 — CID 159527588

IUPAC4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol
SMILESCC(C)(C)c1cc(CSCCCSCc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(CSCCSCc2cc(C(C)(C)C)cc(-c3ccccc3)c2O)c(O)c(-c2ccccc2)c1.CC(C)(C)c1cc(CSCCSCc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(CSc2ccccc2SCc2cc(C(C)(C)C)cc(-c3ccccc3)c2O)c(O)c(-c2ccccc2)c1.CC(C)(C)c1cc(CSc2ccccc2SCc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1
InChIInChI=1S/C40H42O2S2.C36H42O2S2.C36H50O2S2.C33H52O2S2.C32H50O2S2/c1-39(2,3)31-21-29(37(41)33(23-31)27-15-9-7-10-16-27)25-43-35-19-13-14-20-36(35)44-26-30-22-32(40(4,5)6)24-34(38(30)42)28-17-11-8-12-18-28;1-35(2,3)29-19-27(33(37)31(21-29)25-13-9-7-10-14-25)23-39-17-18-40-24-28-20-30(36(4,5)6)22-32(34(28)38)26-15-11-8-12-16-26;1-33(2,3)25-17-23(31(37)27(19-25)35(7,8)9)21-39-29-15-13-14-16-30(29)40-22-24-18-26(34(4,5)6)20-28(32(24)38)36(10,11)12;1-30(2,3)24-16-22(28(34)26(18-24)32(7,8)9)20-36-14-13-15-37-21-23-17-25(31(4,5)6)19-27(29(23)35)33(10,11)12;1-29(2,3)23-15-21(27(33)25(17-23)31(7,8)9)19-35-13-14-36-20-22-16-24(30(4,5)6)18-26(28(22)34)32(10,11)12/h7-24,41-42H,25-26H2,1-6H3;7-16,19-22,37-38H,17-18,23-24H2,1-6H3;13-20,37-38H,21-22H2,1-12H3;16-19,34-35H,13-15,20-21H2,1-12H3;15-18,33-34H,13-14,19-20H2,1-12H3
InChIKeyMCOQZMOFBCKRDT-UHFFFAOYSA-N
MW2844.49 g/mol
LogP51.98
Rot. Bonds38

About 4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol

4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol (PubChem CID 159527588) has the molecular formula C177H236O10S10 and a molecular weight of 2844.49 g/mol. Its IUPAC name is 4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol.

Molecular Properties

Compound Name4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol
PubChem CID159527588
Molecular FormulaC177H236O10S10
Molecular Weight2844.49 g/mol
Exact Mass2841.52
IUPAC Name4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol
SMILESCC(C)(C)c1cc(CSCCCSCc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(CSCCSCc2cc(C(C)(C)C)cc(-c3ccccc3)c2O)c(O)c(-c2ccccc2)c1.CC(C)(C)c1cc(CSCCSCc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(CSc2ccccc2SCc2cc(C(C)(C)C)cc(-c3ccccc3)c2O)c(O)c(-c2ccccc2)c1.CC(C)(C)c1cc(CSc2ccccc2SCc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1
InChIInChI=1S/C40H42O2S2.C36H42O2S2.C36H50O2S2.C33H52O2S2.C32H50O2S2/c1-39(2,3)31-21-29(37(41)33(23-31)27-15-9-7-10-16-27)25-43-35-19-13-14-20-36(35)44-26-30-22-32(40(4,5)6)24-34(38(30)42)28-17-11-8-12-18-28;1-35(2,3)29-19-27(33(37)31(21-29)25-13-9-7-10-14-25)23-39-17-18-40-24-28-20-30(36(4,5)6)22-32(34(28)38)26-15-11-8-12-16-26;1-33(2,3)25-17-23(31(37)27(19-25)35(7,8)9)21-39-29-15-13-14-16-30(29)40-22-24-18-26(34(4,5)6)20-28(32(24)38)36(10,11)12;1-30(2,3)24-16-22(28(34)26(18-24)32(7,8)9)20-36-14-13-15-37-21-23-17-25(31(4,5)6)19-27(29(23)35)33(10,11)12;1-29(2,3)23-15-21(27(33)25(17-23)31(7,8)9)19-35-13-14-36-20-22-16-24(30(4,5)6)18-26(28(22)34)32(10,11)12/h7-24,41-42H,25-26H2,1-6H3;7-16,19-22,37-38H,17-18,23-24H2,1-6H3;13-20,37-38H,21-22H2,1-12H3;16-19,34-35H,13-15,20-21H2,1-12H3;15-18,33-34H,13-14,19-20H2,1-12H3
InChIKeyMCOQZMOFBCKRDT-UHFFFAOYSA-N
XLogP51.98
TPSA202.30 Ų
H-Bond Donors10
H-Bond Acceptors20
Rotatable Bonds38
Heavy Atoms197
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002844.49
LogP ≤ 551.98
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze 4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol?
The IUPAC name of 4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol (CID 159527588) is 4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol.
What is the SMILES notation for 4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol?
The canonical SMILES for 4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol is CC(C)(C)c1cc(CSCCCSCc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(CSCCSCc2cc(C(C)(C)C)cc(-c3ccccc3)c2O)c(O)c(-c2ccccc2)c1.CC(C)(C)c1cc(CSCCSCc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1.CC(C)(C)c1cc(CSc2ccccc2SCc2cc(C(C)(C)C)cc(-c3ccccc3)c2O)c(O)c(-c2ccccc2)c1.CC(C)(C)c1cc(CSc2ccccc2SCc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1.
What is the InChIKey of 4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol?
The InChIKey is MCOQZMOFBCKRDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H42O2S2.C36H42O2S2.C36H50O2S2.C33H52O2S2.C32H50O2S2/c1-39(2,3)31-21-29(37(41)33(23-31)27-15-9-7-10-16-27)25-43-35-19-13-14-20-36(35)44-26-30-22-32(40(4,5)6)24-34(38(30)42)28-17-11-8-12-18-28;1-35(2,3)29-19-27(33(37)31(21-29)25-13-9-7-10-14-25)23-39-17-18-40-24-28-20-30(36(4,5)6)22-32(34(28)38)26-15-11-8-12-16-26;1-33(2,3)25-17-23(31(37)27(19-25)35(7,8)9)21-39-29-15-13-14-16-30(29)40-22-24-18-26(34(4,5)6)20-28(32(24)38)36(10,11)12;1-30(2,3)24-16-22(28(34)26(18-24)32(7,8)9)20-36-14-13-15-37-21-23-17-25(31(4,5)6)19-27(29(23)35)33(10,11)12;1-29(2,3)23-15-21(27(33)25(17-23)31(7,8)9)19-35-13-14-36-20-22-16-24(30(4,5)6)18-26(28(22)34)32(10,11)12/h7-24,41-42H,25-26H2,1-6H3;7-16,19-22,37-38H,17-18,23-24H2,1-6H3;13-20,37-38H,21-22H2,1-12H3;16-19,34-35H,13-15,20-21H2,1-12H3;15-18,33-34H,13-14,19-20H2,1-12H3.
What are the key properties of 4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol?
4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol has a molecular weight of 2844.49 g/mol, XLogP of 51.98, 38 rotatable bonds, 10 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-2-[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]ethylsulfanylmethyl]-6-phenylphenol;4-tert-butyl-2-[[2-[(5-tert-butyl-2-hydroxy-3-phenylphenyl)methylsulfanyl]phenyl]sulfanylmethyl]-6-phenylphenol;2,4-ditert-butyl-6-[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]ethylsulfanylmethyl]phenol;2,4-ditert-butyl-6-[[2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]phenyl]sulfanylmethyl]phenol;2,4-ditert-butyl-6-[3-[(3,5-ditert-butyl-2-hydroxyphenyl)methylsulfanyl]propylsulfanylmethyl]phenol is sourced from PubChem (CID 159527588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).