2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole

C227H263BrCl4N12O13S2 — CID 158468526

About 2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole

2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole (PubChem CID 158468526) has the molecular formula C227H263BrCl4N12O13S2 and a molecular weight of 3653.52 g/mol. Its IUPAC name is 2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole.

Molecular Properties

• Compound Name: 2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole
• PubChem CID: 158468526
• Molecular Formula: C227H263BrCl4N12O13S2
• Molecular Weight: 3653.52 g/mol
• Exact Mass: 3647.77
• IUPAC Name: 2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole
• SMILES: CCCCCOC1(/C=C/C2=C(Cl)/C(=C/C=C3\N(C)c4ccccc4C3(C)C)CC2)N(C)c2ccccc2C1(C)C.CCCCOc1ccc2c(c1)C(C)(C)/C(=C/C=C1\CCC(/C=C/C3(OC#CC#CC#CCl)N(C)c4ccc(OCCCC)cc4C3(C)C)=C1Br)N2C.COC1(/C=C/C2=C(Sc3ccccc3)/C(=C/C=C3\N(C)c4ccccc4C3(C)C)CC2)N(C)c2ccccc2C1(C)C.COCCOC1(/C=C/C2=C(Cl)/C(=C/C=C3\N(C)c4ccccc4C3(C)C)CC2)N(C)c2ccccc2C1(C)C.COc1ccc2c(c1)C(C)(C)/C(=C/C=C1\CCC(/C=C/C3(OC)N(C)c4ccc(OC)cc4C3(C)C)=C1SCC(=O)O)N2C.Cc1ccc(OC2(/C=C/C3=C(Cl)/C(=C/C=C4\N(C)c5ccccc5C4(C)C)CC3)N(C)c3ccccc3C2(C)C)cc1
• InChI: InChI=1S/C45H50BrClN2O3.C38H41ClN2O.C38H42N2OS.C36H45ClN2O.C36H44N2O5S.C34H41ClN2O2/c1-9-11-28-50-35-20-22-39-37(31-35)43(3,4)41(48(39)7)24-19-33-17-18-34(42(33)46)25-26-45(52-30-16-14-13-15-27-47)44(5,6)38-32-36(51-29-12-10-2)21-23-40(38)49(45)8;1-26-16-21-29(22-17-26)42-38(37(4,5)31-13-9-11-15-33(31)41(38)7)25-24-28-19-18-27(35(28)39)20-23-34-36(2,3)30-12-8-10-14-32(30)40(34)6;1-36(2)30-17-11-13-19-32(30)39(5)34(36)24-23-27-21-22-28(35(27)42-29-15-9-8-10-16-29)25-26-38(41-7)37(3,4)31-18-12-14-20-33(31)40(38)6;1-8-9-14-25-40-36(35(4,5)29-16-11-13-18-31(29)39(36)7)24-23-27-20-19-26(33(27)37)21-22-32-34(2,3)28-15-10-12-17-30(28)38(32)6;1-34(2)27-20-25(41-7)13-15-29(27)37(5)31(34)17-12-23-10-11-24(33(23)44-22-32(39)40)18-19-36(43-9)35(3,4)28-21-26(42-8)14-16-30(28)38(36)6;1-32(2)26-12-8-10-14-28(26)36(5)30(32)19-18-24-16-17-25(31(24)35)20-21-34(39-23-22-38-7)33(3,4)27-13-9-11-15-29(27)37(34)6/h19-26,31-32H,9-12,17-18,28-29H2,1-8H3;8-17,20-25H,18-19H2,1-7H3;8-20,23-26H,21-22H2,1-7H3;10-13,15-18,21-24H,8-9,14,19-20,25H2,1-7H3;12-21H,10-11,22H2,1-9H3,(H,39,40);8-15,18-21H,16-17,22-23H2,1-7H3/b26-25+,33-19+,41-24-;25-24+,27-20+,34-23-;26-25+,27-23+,34-24-;24-23+,26-21+,32-22-;19-18+,23-12+,31-17-;21-20+,24-18+,30-19-
• InChIKey: HGBFYHWNSATXKY-INUSTADESA-N
• XLogP: 54.54
• TPSA: 177.71 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 26
• Rotatable Bonds: 47
• Heavy Atoms: 259
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3653.52
LogP ≤ 5	54.54
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole?

The IUPAC name of 2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole (CID 158468526) is 2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole.

What is the SMILES notation for 2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole?

The canonical SMILES for 2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole is CCCCCOC1(/C=C/C2=C(Cl)/C(=C/C=C3\N(C)c4ccccc4C3(C)C)CC2)N(C)c2ccccc2C1(C)C.CCCCOc1ccc2c(c1)C(C)(C)/C(=C/C=C1\CCC(/C=C/C3(OC#CC#CC#CCl)N(C)c4ccc(OCCCC)cc4C3(C)C)=C1Br)N2C.COC1(/C=C/C2=C(Sc3ccccc3)/C(=C/C=C3\N(C)c4ccccc4C3(C)C)CC2)N(C)c2ccccc2C1(C)C.COCCOC1(/C=C/C2=C(Cl)/C(=C/C=C3\N(C)c4ccccc4C3(C)C)CC2)N(C)c2ccccc2C1(C)C.COc1ccc2c(c1)C(C)(C)/C(=C/C=C1\CCC(/C=C/C3(OC)N(C)c4ccc(OC)cc4C3(C)C)=C1SCC(=O)O)N2C.Cc1ccc(OC2(/C=C/C3=C(Cl)/C(=C/C=C4\N(C)c5ccccc5C4(C)C)CC3)N(C)c3ccccc3C2(C)C)cc1.

What is the InChIKey of 2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole?

The InChIKey is HGBFYHWNSATXKY-INUSTADESA-N. The full InChI is InChI=1S/C45H50BrClN2O3.C38H41ClN2O.C38H42N2OS.C36H45ClN2O.C36H44N2O5S.C34H41ClN2O2/c1-9-11-28-50-35-20-22-39-37(31-35)43(3,4)41(48(39)7)24-19-33-17-18-34(42(33)46)25-26-45(52-30-16-14-13-15-27-47)44(5,6)38-32-36(51-29-12-10-2)21-23-40(38)49(45)8;1-26-16-21-29(22-17-26)42-38(37(4,5)31-13-9-11-15-33(31)41(38)7)25-24-28-19-18-27(35(28)39)20-23-34-36(2,3)30-12-8-10-14-32(30)40(34)6;1-36(2)30-17-11-13-19-32(30)39(5)34(36)24-23-27-21-22-28(35(27)42-29-15-9-8-10-16-29)25-26-38(41-7)37(3,4)31-18-12-14-20-33(31)40(38)6;1-8-9-14-25-40-36(35(4,5)29-16-11-13-18-31(29)39(36)7)24-23-27-20-19-26(33(27)37)21-22-32-34(2,3)28-15-10-12-17-30(28)38(32)6;1-34(2)27-20-25(41-7)13-15-29(27)37(5)31(34)17-12-23-10-11-24(33(23)44-22-32(39)40)18-19-36(43-9)35(3,4)28-21-26(42-8)14-16-30(28)38(36)6;1-32(2)26-12-8-10-14-28(26)36(5)30(32)19-18-24-16-17-25(31(24)35)20-21-34(39-23-22-38-7)33(3,4)27-13-9-11-15-29(27)37(34)6/h19-26,31-32H,9-12,17-18,28-29H2,1-8H3;8-17,20-25H,18-19H2,1-7H3;8-20,23-26H,21-22H2,1-7H3;10-13,15-18,21-24H,8-9,14,19-20,25H2,1-7H3;12-21H,10-11,22H2,1-9H3,(H,39,40);8-15,18-21H,16-17,22-23H2,1-7H3/b26-25+,33-19+,41-24-;25-24+,27-20+,34-23-;26-25+,27-23+,34-24-;24-23+,26-21+,32-22-;19-18+,23-12+,31-17-;21-20+,24-18+,30-19-.

What are the key properties of 2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole?

2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole has a molecular weight of 3653.52 g/mol, XLogP of 54.54, 47 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(E)-2-[(3E)-2-bromo-3-[(2Z)-2-(5-butoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-5-butoxy-2-(6-chlorohexa-1,3,5-triynoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-2-(2-methoxyethoxy)-1,3,3-trimethylindole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-(4-methylphenoxy)indole;2-[(E)-2-[(3E)-2-chloro-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]-1,3,3-trimethyl-2-pentoxyindole;2-[(5E)-2-[(E)-2-(2,5-dimethoxy-1,3,3-trimethylindol-2-yl)ethenyl]-5-[(2Z)-2-(5-methoxy-1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]sulfanylacetic acid;2-methoxy-1,3,3-trimethyl-2-[(E)-2-[(3E)-2-phenylsulfanyl-3-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopenten-1-yl]ethenyl]indole is sourced from PubChem (CID 158468526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).