2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate

C65H74Cl2N6O10Si2 — CID 162079701

IUPAC2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate
SMILESCOC(=O)C(=O)c1c(Cl)[nH]c2ccccc12.COc1ccc2c(c1)c(C1=C(c3c(Cl)[nH]c4ccccc34)C(=O)NC1=O)cn2C1C=C[C@@H](O[Si](C)(C)C(C)(C)C)C1.COc1ccc2c(c1)c(CC(N)=O)cn2C1C=C[C@@H](O[Si](C)(C)C(C)(C)C)C1
InChIInChI=1S/C32H34ClN3O4Si.C22H32N2O3Si.C11H8ClNO3/c1-32(2,3)41(5,6)40-20-12-11-18(15-20)36-17-23(22-16-19(39-4)13-14-25(22)36)27-28(31(38)35-30(27)37)26-21-9-7-8-10-24(21)34-29(26)33;1-22(2,3)28(5,6)27-18-8-7-16(12-18)24-14-15(11-21(23)25)19-13-17(26-4)9-10-20(19)24;1-16-11(15)9(14)8-6-4-2-3-5-7(6)13-10(8)12/h7-14,16-18,20,34H,15H2,1-6H3,(H,35,37,38);7-10,13-14,16,18H,11-12H2,1-6H3,(H2,23,25);2-5,13H,1H3/t18?,20-;16?,18-;/m11./s1
InChIKeyZCEDFPUSMLASTP-ZBPSNVSUSA-N
MW1226.42 g/mol
LogP13.99
Rot. Bonds14

About 2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate

2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate (PubChem CID 162079701) has the molecular formula C65H74Cl2N6O10Si2 and a molecular weight of 1226.42 g/mol. Its IUPAC name is 2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate.

Molecular Properties

Compound Name2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate
PubChem CID162079701
Molecular FormulaC65H74Cl2N6O10Si2
Molecular Weight1226.42 g/mol
Exact Mass1224.44
IUPAC Name2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate
SMILESCOC(=O)C(=O)c1c(Cl)[nH]c2ccccc12.COc1ccc2c(c1)c(C1=C(c3c(Cl)[nH]c4ccccc34)C(=O)NC1=O)cn2C1C=C[C@@H](O[Si](C)(C)C(C)(C)C)C1.COc1ccc2c(c1)c(CC(N)=O)cn2C1C=C[C@@H](O[Si](C)(C)C(C)(C)C)C1
InChIInChI=1S/C32H34ClN3O4Si.C22H32N2O3Si.C11H8ClNO3/c1-32(2,3)41(5,6)40-20-12-11-18(15-20)36-17-23(22-16-19(39-4)13-14-25(22)36)27-28(31(38)35-30(27)37)26-21-9-7-8-10-24(21)34-29(26)33;1-22(2,3)28(5,6)27-18-8-7-16(12-18)24-14-15(11-21(23)25)19-13-17(26-4)9-10-20(19)24;1-16-11(15)9(14)8-6-4-2-3-5-7(6)13-10(8)12/h7-14,16-18,20,34H,15H2,1-6H3,(H,35,37,38);7-10,13-14,16,18H,11-12H2,1-6H3,(H2,23,25);2-5,13H,1H3/t18?,20-;16?,18-;/m11./s1
InChIKeyZCEDFPUSMLASTP-ZBPSNVSUSA-N
XLogP13.99
TPSA210.99 Ų
H-Bond Donors4
H-Bond Acceptors12
Rotatable Bonds14
Heavy Atoms85
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001226.42
LogP ≤ 513.99
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate 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

ethyl 4-[(3R)-5-chloro-2-oxo-1,3-dihydroindol-3-yl]-1-[2-(5-methoxy-1H-indol-3-yl)ethyl]-5-phenylpyrrole-3-carboxylate
CID 139199454
3-[1-[(1R,4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-2-chloroindol-3-yl]-4-(5-methoxy-1H-indol-3-yl)pyrrole-2,5-dione
CID 58936610
3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione
CID 58936675
(1S,4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-ol;3-[1-[(1R,4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-2-chloroindol-3-yl]-4-(5-methoxy-1H-indol-3-yl)pyrrole-2,5-dione;3-(2-chloro-1H-indol-3-yl)-4-(5-methoxy-1H-indol-3-yl)pyrrole-2,5-dione;methane
CID 157390455
3-[1-[(1R,4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-2-chloroindol-3-yl]-4-(5-methoxy-1H-indol-3-yl)pyrrole-2,5-dione;3-[(1R,4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-19-methoxy-3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1,4,6,8,10,15,17(22),18,20-nonaene-12,14-dione
CID 157429148
3-(2-chloro-1H-indol-3-yl)-4-(1-cyclohex-2-en-1-ylindol-3-yl)pyrrole-2,5-dione;2-(1-cyclohex-2-en-1-ylindol-3-yl)acetamide;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate
CID 157579073
3-(2-chloro-1H-indol-3-yl)-4-(5-methoxy-1H-indol-3-yl)pyrrole-2,5-dione;methane;2-(5-methoxy-1H-indol-3-yl)acetamide;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate
CID 158091807
2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]indol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]indol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate
CID 158198542
3-(5-bromo-2-chloro-1H-indol-3-yl)-4-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]indol-3-yl]pyrrole-2,5-dione;2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]indol-3-yl]acetamide;methyl 2-(5-bromo-2-chloro-1H-indol-3-yl)-2-oxoacetate
CID 158347296
2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]indol-3-yl]acetamide;3-[1-[4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]indol-3-yl]-4-(2,6-dichloro-1H-indol-3-yl)pyrrole-2,5-dione;methane;methyl 2-(2,6-dichloro-1H-indol-3-yl)-2-oxoacetate
CID 158385941
3-(5-bromo-2-chloro-1H-indol-3-yl)-4-(5-methoxy-1H-indol-3-yl)pyrrole-2,5-dione;methane;2-(5-methoxy-1H-indol-3-yl)acetamide;methyl 2-(5-bromo-2-chloro-1H-indol-3-yl)-2-oxoacetate
CID 158700534
3-(5-bromo-2-chloro-1H-indol-3-yl)-4-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]indol-3-yl]pyrrole-2,5-dione;2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]indol-3-yl]acetamide;methane;methyl 2-(5-bromo-2-chloro-1H-indol-3-yl)-2-oxoacetate
CID 158855878

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate?
The IUPAC name of 2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate (CID 162079701) is 2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate.
What is the SMILES notation for 2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate?
The canonical SMILES for 2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate is COC(=O)C(=O)c1c(Cl)[nH]c2ccccc12.COc1ccc2c(c1)c(C1=C(c3c(Cl)[nH]c4ccccc34)C(=O)NC1=O)cn2C1C=C[C@@H](O[Si](C)(C)C(C)(C)C)C1.COc1ccc2c(c1)c(CC(N)=O)cn2C1C=C[C@@H](O[Si](C)(C)C(C)(C)C)C1.
What is the InChIKey of 2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate?
The InChIKey is ZCEDFPUSMLASTP-ZBPSNVSUSA-N. The full InChI is InChI=1S/C32H34ClN3O4Si.C22H32N2O3Si.C11H8ClNO3/c1-32(2,3)41(5,6)40-20-12-11-18(15-20)36-17-23(22-16-19(39-4)13-14-25(22)36)27-28(31(38)35-30(27)37)26-21-9-7-8-10-24(21)34-29(26)33;1-22(2,3)28(5,6)27-18-8-7-16(12-18)24-14-15(11-21(23)25)19-13-17(26-4)9-10-20(19)24;1-16-11(15)9(14)8-6-4-2-3-5-7(6)13-10(8)12/h7-14,16-18,20,34H,15H2,1-6H3,(H,35,37,38);7-10,13-14,16,18H,11-12H2,1-6H3,(H2,23,25);2-5,13H,1H3/t18?,20-;16?,18-;/m11./s1.
What are the key properties of 2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate?
2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate has a molecular weight of 1226.42 g/mol, XLogP of 13.99, 14 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]acetamide;3-[1-[(4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]-5-methoxyindol-3-yl]-4-(2-chloro-1H-indol-3-yl)pyrrole-2,5-dione;methyl 2-(2-chloro-1H-indol-3-yl)-2-oxoacetate is sourced from PubChem (CID 162079701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).