1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene

C34H32O6 — CID 102287735

IUPAC1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene
SMILESCOc1ccc(C2C3=C(c4cc(OC)cc(OC)c42)C(c2ccc(OC)cc2)c2c(OC)cc(OC)cc23)cc1
InChIInChI=1S/C34H32O6/c1-35-21-11-7-19(8-12-21)29-31-25(15-23(37-3)17-27(31)39-5)34-30(20-9-13-22(36-2)14-10-20)32-26(33(29)34)16-24(38-4)18-28(32)40-6/h7-18,29-30H,1-6H3
InChIKeyGATAIPUTCTUYEB-UHFFFAOYSA-N
MW536.62 g/mol
LogP6.94
Rot. Bonds8

About 1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene

1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene (PubChem CID 102287735) has the molecular formula C34H32O6 and a molecular weight of 536.62 g/mol. Its IUPAC name is 1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene.

Molecular Properties

Compound Name1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene
PubChem CID102287735
Molecular FormulaC34H32O6
Molecular Weight536.62 g/mol
Exact Mass536.22
IUPAC Name1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene
SMILESCOc1ccc(C2C3=C(c4cc(OC)cc(OC)c42)C(c2ccc(OC)cc2)c2c(OC)cc(OC)cc23)cc1
InChIInChI=1S/C34H32O6/c1-35-21-11-7-19(8-12-21)29-31-25(15-23(37-3)17-27(31)39-5)34-30(20-9-13-22(36-2)14-10-20)32-26(33(29)34)16-24(38-4)18-28(32)40-6/h7-18,29-30H,1-6H3
InChIKeyGATAIPUTCTUYEB-UHFFFAOYSA-N
XLogP6.94
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500536.62
LogP ≤ 56.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

(2R,3S,4R)-5,7-dimethoxy-2-(4-methoxyphenyl)-3,4-dihydro-2H-chromene-3,4-diol
CID 14080194
(4S)-5,7-dimethoxy-4-(4-methoxyphenyl)-3,4-dihydrochromen-2-one
CID 6540146
9-bromo-4,6,12,14-tetramethoxy-10-(4-methoxyphenyl)tricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-one
CID 118516367
2,4,6,8-tetramethoxy-5-(2,4,6-trimethoxyphenyl)-5H-benzo[d][1,3]benzodioxocine
CID 70993959
(1R,2R,3Z)-2-(3,5-dimethoxyphenyl)-5,7-dimethoxy-3-[(4-methoxyphenyl)methylidene]-1-phenyl-1,2-dihydroindene
CID 71654199
(1S,2S,3S)-1-chloro-3-(3,5-dimethoxyphenyl)-4,6-dimethoxy-2-(4-methoxyphenyl)-2,3-dihydro-1H-indene
CID 89202386
(4R)-5,7-dimethoxy-4-(4-methoxyphenyl)-3,4-dihydro-1H-quinolin-2-one
CID 7248901
(1R)-5,7-dimethoxy-2-(3-methoxy-5-methylphenyl)-1-(4-methoxyphenyl)-1H-indene;(1R)-1-(3,5-dimethoxyphenyl)-5,7-dimethoxy-2-(4-methoxyphenyl)-1H-indene
CID 160699059
4-[1,3,6,8-tetramethoxy-10-(4-methoxyphenyl)-4b,5,9b,10-tetrahydroindeno[2,3-a]inden-5-yl]benzaldehyde
CID 59611719
(2S,3S)-3-(3,4-dimethoxyphenyl)-2-(3,5-dimethoxyphenyl)-4,6-dimethoxy-2,3-dihydroinden-1-one
CID 71028102
(3S)-3-(4-fluorophenyl)-4,6-dimethoxy-2,3-dihydroinden-1-one
CID 132569592
(4-methoxyphenyl)-(2,4,6-trimethoxyphenyl)iodanium
CID 122206249

Frequently Asked Questions

What is the IUPAC name of 1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene?
The IUPAC name of 1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene (CID 102287735) is 1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene.
What is the SMILES notation for 1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene?
The canonical SMILES for 1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene is COc1ccc(C2C3=C(c4cc(OC)cc(OC)c42)C(c2ccc(OC)cc2)c2c(OC)cc(OC)cc23)cc1.
What is the InChIKey of 1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene?
The InChIKey is GATAIPUTCTUYEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H32O6/c1-35-21-11-7-19(8-12-21)29-31-25(15-23(37-3)17-27(31)39-5)34-30(20-9-13-22(36-2)14-10-20)32-26(33(29)34)16-24(38-4)18-28(32)40-6/h7-18,29-30H,1-6H3.
What are the key properties of 1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene?
1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene has a molecular weight of 536.62 g/mol, XLogP of 6.94, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,6,8-tetramethoxy-5,10-bis(4-methoxyphenyl)-5,10-dihydroindeno[2,1-a]indene is sourced from PubChem (CID 102287735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).