2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate

C306H412N4O10-4 — CID 164986668

IUPAC2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate
SMILESCCCC1(CCC)CC(C)(C)c2c1cc1c(c2-c2ccc(N(c3ccc(-c4c5c(cc6c4C(C)(C)CC6(CCC)CCC)C(CCC)(CCC)CC5(C)C)cc3)c3cc(O)c(C4=C([O-])C(c5c(O)cc(N(c6ccc(-c7c8c(cc9c7C(C)(C)CC9(CCC)CCC)C(CCC)(CCC)CC8(C)C)cc6)c6ccc(-c7c8c(cc9c7C(C)(C)CC9(CCC)CCC)C(CCC)(CCC)CC8(C)C)cc6)cc5O)=C4[O-])c(O)c3)cc2)C(C)(C)CC1(CCC)CCC.CCCC1(CCC)CC(C)(C)c2c1cc1c(c2-c2ccc(N(c3ccc(-c4c5c(cc6c4C(C)(C)CC6(CCC)CCC)C(CCC)(CCC)CC5(C)C)cc3)c3ccc(C4=C([O-])C(c5ccc(N(c6ccc(-c7c8c(cc9c7C(C)(C)CC9(CCC)CCC)C(CCC)(CCC)CC8(C)C)cc6)c6ccc(-c7c8c(cc9c7C(C)(C)CC9(CCC)CCC)C(CCC)(CCC)CC8(C)C)cc6)cc5OC)=C4[O-])c(CO)c3)cc2)C(C)(C)CC1(CCC)CCC
InChIInChI=1S/C154H210N2O4.C152H206N2O6/c1-34-70-147(71-35-2)93-139(17,18)129-114(147)88-115-130(140(19,20)94-148(115,72-36-3)73-37-4)123(129)101-50-58-106(59-51-101)155(107-60-52-102(53-61-107)124-131-116(149(74-38-5,75-39-6)95-141(131,21)22)89-117-132(124)142(23,24)96-150(117,76-40-7)77-41-8)110-66-68-112(105(86-110)92-157)127-137(158)128(138(127)159)113-69-67-111(87-122(113)160-33)156(108-62-54-103(55-63-108)125-133-118(151(78-42-9,79-43-10)97-143(133,25)26)90-119-134(125)144(27,28)98-152(119,80-44-11)81-45-12)109-64-56-104(57-65-109)126-135-120(153(82-46-13,83-47-14)99-145(135,29)30)91-121-136(126)146(31,32)100-154(121,84-48-15)85-49-16;1-33-65-145(66-34-2)89-137(17,18)127-107(145)85-108-128(138(19,20)90-146(108,67-35-3)68-36-4)119(127)97-49-57-101(58-50-97)153(102-59-51-98(52-60-102)120-129-109(147(69-37-5,70-38-6)91-139(129,21)22)86-110-130(120)140(23,24)92-148(110,71-39-7)72-40-8)105-81-115(155)123(116(156)82-105)125-135(159)126(136(125)160)124-117(157)83-106(84-118(124)158)154(103-61-53-99(54-62-103)121-131-111(149(73-41-9,74-42-10)93-141(131,25)26)87-112-132(121)142(27,28)94-150(112,75-43-11)76-44-12)104-63-55-100(56-64-104)122-133-113(151(77-45-13,78-46-14)95-143(133,29)30)88-114-134(122)144(31,32)96-152(114,79-47-15)80-48-16/h50-69,86-91,157-159H,34-49,70-85,92-100H2,1-33H3;49-64,81-88,155-160H,33-48,65-80,89-96H2,1-32H3/p-4
InChIKeyGGMOKJGKFCJDDW-UHFFFAOYSA-J
MW4306.68 g/mol
LogP84.93
Rot. Bonds90

About 2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate

2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate (PubChem CID 164986668) has the molecular formula C306H412N4O10-4 and a molecular weight of 4306.68 g/mol. Its IUPAC name is 2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate.

Molecular Properties

Compound Name2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate
PubChem CID164986668
Molecular FormulaC306H412N4O10-4
Molecular Weight4306.68 g/mol
Exact Mass4303.19
IUPAC Name2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate
SMILESCCCC1(CCC)CC(C)(C)c2c1cc1c(c2-c2ccc(N(c3ccc(-c4c5c(cc6c4C(C)(C)CC6(CCC)CCC)C(CCC)(CCC)CC5(C)C)cc3)c3cc(O)c(C4=C([O-])C(c5c(O)cc(N(c6ccc(-c7c8c(cc9c7C(C)(C)CC9(CCC)CCC)C(CCC)(CCC)CC8(C)C)cc6)c6ccc(-c7c8c(cc9c7C(C)(C)CC9(CCC)CCC)C(CCC)(CCC)CC8(C)C)cc6)cc5O)=C4[O-])c(O)c3)cc2)C(C)(C)CC1(CCC)CCC.CCCC1(CCC)CC(C)(C)c2c1cc1c(c2-c2ccc(N(c3ccc(-c4c5c(cc6c4C(C)(C)CC6(CCC)CCC)C(CCC)(CCC)CC5(C)C)cc3)c3ccc(C4=C([O-])C(c5ccc(N(c6ccc(-c7c8c(cc9c7C(C)(C)CC9(CCC)CCC)C(CCC)(CCC)CC8(C)C)cc6)c6ccc(-c7c8c(cc9c7C(C)(C)CC9(CCC)CCC)C(CCC)(CCC)CC8(C)C)cc6)cc5OC)=C4[O-])c(CO)c3)cc2)C(C)(C)CC1(CCC)CCC
InChIInChI=1S/C154H210N2O4.C152H206N2O6/c1-34-70-147(71-35-2)93-139(17,18)129-114(147)88-115-130(140(19,20)94-148(115,72-36-3)73-37-4)123(129)101-50-58-106(59-51-101)155(107-60-52-102(53-61-107)124-131-116(149(74-38-5,75-39-6)95-141(131,21)22)89-117-132(124)142(23,24)96-150(117,76-40-7)77-41-8)110-66-68-112(105(86-110)92-157)127-137(158)128(138(127)159)113-69-67-111(87-122(113)160-33)156(108-62-54-103(55-63-108)125-133-118(151(78-42-9,79-43-10)97-143(133,25)26)90-119-134(125)144(27,28)98-152(119,80-44-11)81-45-12)109-64-56-104(57-65-109)126-135-120(153(82-46-13,83-47-14)99-145(135,29)30)91-121-136(126)146(31,32)100-154(121,84-48-15)85-49-16;1-33-65-145(66-34-2)89-137(17,18)127-107(145)85-108-128(138(19,20)90-146(108,67-35-3)68-36-4)119(127)97-49-57-101(58-50-97)153(102-59-51-98(52-60-102)120-129-109(147(69-37-5,70-38-6)91-139(129,21)22)86-110-130(120)140(23,24)92-148(110,71-39-7)72-40-8)105-81-115(155)123(116(156)82-105)125-135(159)126(136(125)160)124-117(157)83-106(84-118(124)158)154(103-61-53-99(54-62-103)121-131-111(149(73-41-9,74-42-10)93-141(131,25)26)87-112-132(121)142(27,28)94-150(112,75-43-11)76-44-12)104-63-55-100(56-64-104)122-133-113(151(77-45-13,78-46-14)95-143(133,29)30)88-114-134(122)144(31,32)96-152(114,79-47-15)80-48-16/h50-69,86-91,157-159H,34-49,70-85,92-100H2,1-33H3;49-64,81-88,155-160H,33-48,65-80,89-96H2,1-32H3/p-4
InChIKeyGGMOKJGKFCJDDW-UHFFFAOYSA-J
XLogP84.93
TPSA215.58 Ų
H-Bond Donors5
H-Bond Acceptors14
Rotatable Bonds90
Heavy Atoms320
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004306.68
LogP ≤ 584.93
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1014

Analyze 2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate with MolForge

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

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate?
The IUPAC name of 2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate (CID 164986668) is 2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate.
What is the SMILES notation for 2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate?
The canonical SMILES for 2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate is CCCC1(CCC)CC(C)(C)c2c1cc1c(c2-c2ccc(N(c3ccc(-c4c5c(cc6c4C(C)(C)CC6(CCC)CCC)C(CCC)(CCC)CC5(C)C)cc3)c3cc(O)c(C4=C([O-])C(c5c(O)cc(N(c6ccc(-c7c8c(cc9c7C(C)(C)CC9(CCC)CCC)C(CCC)(CCC)CC8(C)C)cc6)c6ccc(-c7c8c(cc9c7C(C)(C)CC9(CCC)CCC)C(CCC)(CCC)CC8(C)C)cc6)cc5O)=C4[O-])c(O)c3)cc2)C(C)(C)CC1(CCC)CCC.CCCC1(CCC)CC(C)(C)c2c1cc1c(c2-c2ccc(N(c3ccc(-c4c5c(cc6c4C(C)(C)CC6(CCC)CCC)C(CCC)(CCC)CC5(C)C)cc3)c3ccc(C4=C([O-])C(c5ccc(N(c6ccc(-c7c8c(cc9c7C(C)(C)CC9(CCC)CCC)C(CCC)(CCC)CC8(C)C)cc6)c6ccc(-c7c8c(cc9c7C(C)(C)CC9(CCC)CCC)C(CCC)(CCC)CC8(C)C)cc6)cc5OC)=C4[O-])c(CO)c3)cc2)C(C)(C)CC1(CCC)CCC.
What is the InChIKey of 2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate?
The InChIKey is GGMOKJGKFCJDDW-UHFFFAOYSA-J. The full InChI is InChI=1S/C154H210N2O4.C152H206N2O6/c1-34-70-147(71-35-2)93-139(17,18)129-114(147)88-115-130(140(19,20)94-148(115,72-36-3)73-37-4)123(129)101-50-58-106(59-51-101)155(107-60-52-102(53-61-107)124-131-116(149(74-38-5,75-39-6)95-141(131,21)22)89-117-132(124)142(23,24)96-150(117,76-40-7)77-41-8)110-66-68-112(105(86-110)92-157)127-137(158)128(138(127)159)113-69-67-111(87-122(113)160-33)156(108-62-54-103(55-63-108)125-133-118(151(78-42-9,79-43-10)97-143(133,25)26)90-119-134(125)144(27,28)98-152(119,80-44-11)81-45-12)109-64-56-104(57-65-109)126-135-120(153(82-46-13,83-47-14)99-145(135,29)30)91-121-136(126)146(31,32)100-154(121,84-48-15)85-49-16;1-33-65-145(66-34-2)89-137(17,18)127-107(145)85-108-128(138(19,20)90-146(108,67-35-3)68-36-4)119(127)97-49-57-101(58-50-97)153(102-59-51-98(52-60-102)120-129-109(147(69-37-5,70-38-6)91-139(129,21)22)86-110-130(120)140(23,24)92-148(110,71-39-7)72-40-8)105-81-115(155)123(116(156)82-105)125-135(159)126(136(125)160)124-117(157)83-106(84-118(124)158)154(103-61-53-99(54-62-103)121-131-111(149(73-41-9,74-42-10)93-141(131,25)26)87-112-132(121)142(27,28)94-150(112,75-43-11)76-44-12)104-63-55-100(56-64-104)122-133-113(151(77-45-13,78-46-14)95-143(133,29)30)88-114-134(122)144(31,32)96-152(114,79-47-15)80-48-16/h50-69,86-91,157-159H,34-49,70-85,92-100H2,1-33H3;49-64,81-88,155-160H,33-48,65-80,89-96H2,1-32H3/p-4.
What are the key properties of 2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate?
2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate has a molecular weight of 4306.68 g/mol, XLogP of 84.93, 90 rotatable bonds, 5 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis[2,6-dihydroxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate;2-[2-(hydroxymethyl)-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]-4-[2-methoxy-4-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)-N-[4-(3,3,5,5-tetramethyl-1,1,7,7-tetrapropyl-2,6-dihydro-s-indacen-4-yl)phenyl]anilino]phenyl]cyclobuta-1,3-diene-1,3-diolate is sourced from PubChem (CID 164986668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).