bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane

C151H243Br2N4O4P3S4Sn — CID 158184278

IUPACbis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane
SMILESC.CCCCCCCCCCC(CCCCCCCCCC)CCCN1C(=O)/C(=C2/C(=O)N(CCCC(CCCCCCCCCC)CCCCCCCCCC)c3cc(-c4ccc(-c5ccc(C)s5)s4)ccc32)c2ccc(C)cc21.CCCCCCCCCCC(CCCCCCCCCC)CCCN1C(=O)/C(=C2/C(=O)N(CCCC(CCCCCCCCCC)CCCCCCCCCC)c3cc(Br)ccc32)c2ccc(Br)cc21.Cc1ccc(-c2ccc([Sn](C)(C)C)s2)s1.PPP
InChIInChI=1S/C74H114N2O2S2.C64H104Br2N2O2.C9H7S2.CH4.3CH3.H5P3.Sn/c1-7-11-15-19-23-27-31-35-41-61(42-36-32-28-24-20-16-12-8-2)45-39-55-75-66-57-59(5)47-50-64(66)71(73(75)77)72-65-51-49-63(68-53-54-70(80-68)69-52-48-60(6)79-69)58-67(65)76(74(72)78)56-40-46-62(43-37-33-29-25-21-17-13-9-3)44-38-34-30-26-22-18-14-10-4;1-5-9-13-17-21-25-29-33-39-53(40-34-30-26-22-18-14-10-6-2)43-37-49-67-59-51-55(65)45-47-57(59)61(63(67)69)62-58-48-46-56(66)52-60(58)68(64(62)70)50-38-44-54(41-35-31-27-23-19-15-11-7-3)42-36-32-28-24-20-16-12-8-4;1-7-4-5-9(11-7)8-3-2-6-10-8;;;;;1-3-2;/h47-54,57-58,61-62H,7-46,55-56H2,1-6H3;45-48,51-54H,5-44,49-50H2,1-4H3;2-5H,1H3;1H4;3*1H3;3H,1-2H2;/b72-71+;62-61+;;;;;;;
InChIKeyFYYPCQMRMJRMOC-LYLBMXEOSA-N
MW2678.34 g/mol
LogP52.22
Rot. Bonds92

About bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane

bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane (PubChem CID 158184278) has the molecular formula C151H243Br2N4O4P3S4Sn and a molecular weight of 2678.34 g/mol. Its IUPAC name is bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane.

Molecular Properties

Compound Namebis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane
PubChem CID158184278
Molecular FormulaC151H243Br2N4O4P3S4Sn
Molecular Weight2678.34 g/mol
Exact Mass2675.44
IUPAC Namebis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane
SMILESC.CCCCCCCCCCC(CCCCCCCCCC)CCCN1C(=O)/C(=C2/C(=O)N(CCCC(CCCCCCCCCC)CCCCCCCCCC)c3cc(-c4ccc(-c5ccc(C)s5)s4)ccc32)c2ccc(C)cc21.CCCCCCCCCCC(CCCCCCCCCC)CCCN1C(=O)/C(=C2/C(=O)N(CCCC(CCCCCCCCCC)CCCCCCCCCC)c3cc(Br)ccc32)c2ccc(Br)cc21.Cc1ccc(-c2ccc([Sn](C)(C)C)s2)s1.PPP
InChIInChI=1S/C74H114N2O2S2.C64H104Br2N2O2.C9H7S2.CH4.3CH3.H5P3.Sn/c1-7-11-15-19-23-27-31-35-41-61(42-36-32-28-24-20-16-12-8-2)45-39-55-75-66-57-59(5)47-50-64(66)71(73(75)77)72-65-51-49-63(68-53-54-70(80-68)69-52-48-60(6)79-69)58-67(65)76(74(72)78)56-40-46-62(43-37-33-29-25-21-17-13-9-3)44-38-34-30-26-22-18-14-10-4;1-5-9-13-17-21-25-29-33-39-53(40-34-30-26-22-18-14-10-6-2)43-37-49-67-59-51-55(65)45-47-57(59)61(63(67)69)62-58-48-46-56(66)52-60(58)68(64(62)70)50-38-44-54(41-35-31-27-23-19-15-11-7-3)42-36-32-28-24-20-16-12-8-4;1-7-4-5-9(11-7)8-3-2-6-10-8;;;;;1-3-2;/h47-54,57-58,61-62H,7-46,55-56H2,1-6H3;45-48,51-54H,5-44,49-50H2,1-4H3;2-5H,1H3;1H4;3*1H3;3H,1-2H2;/b72-71+;62-61+;;;;;;;
InChIKeyFYYPCQMRMJRMOC-LYLBMXEOSA-N
XLogP52.22
TPSA81.24 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds92
Heavy Atoms169
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002678.34
LogP ≤ 552.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane with MolForge

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Related Compounds

(3E)-1-(2-hexyldecyl)-3-[1-(2-hexyldecyl)-6-[4-octyl-5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one
CID 118041374
2,5-bis(2-hexyldecyl)-4-[5-(4-methylphenyl)thiophen-2-yl]-1-(5-methylthiophen-2-yl)pyrrolo[3,4-c]pyrrole-3,6-dione
CID 67952901
1,4-bis(3-decylpentadecyl)-3,6-bis(5-methylthiophen-2-yl)pyrrolo[3,2-b]pyrrole-2,5-dione
CID 153316252
1,4-bis[4-(5-methylthiophen-2-yl)phenyl]-2,5-bis(2-octyldodecyl)pyrrolo[3,4-c]pyrrole-3,6-dione
CID 153316228
1,4-bis(5-bromothiophen-2-yl)-2,5-bis[5-[4-(2-octyldodecoxy)phenyl]pentyl]pyrrolo[3,4-c]pyrrole-3,6-dione;1-methyl-4-[5-[5-[5-(5-methylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-2,5-bis[5-[4-(2-octyldodecoxy)phenyl]pentyl]pyrrolo[3,4-c]pyrrole-3,6-dione;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane
CID 157466048
(3E)-3-[6-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)-1-(2-octyldodecyl)-2-oxoindol-3-ylidene]-6-methyl-1-(2-octyldodecyl)indol-2-one
CID 118667959
1,4-bis[2-[4-(2-hexyldecyl)phenoxy]ethyl]-3-methyl-6-(11-methyl-3,7,10,14-tetrathiatetracyclo[6.6.0.02,6.09,13]tetradeca-1(8),2(6),4,9(13),11-pentaen-4-yl)pyrrolo[3,2-b]pyrrole-2,5-dione;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;6-[4-dodecyl-5-[5-[5-(3-dodecyl-5-methylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-3-methylthieno[3,2-b]thiophene-2,5-dione
CID 158530492
(3E,7E)-3,7-bis[6-bromo-1-(2-decyltetradecyl)-2-oxoindol-3-ylidene]furo[2,3-f][1]benzofuran-2,6-dione
CID 90153625
4,8-bis(2-hexyldecyl)-2-(4-methylphenyl)-6-[4-[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-s-indacene-1,5-dione
CID 121309422
1,5-bis(2-decyltetradecyl)-3-[5-[9-(2-ethylhexyl)carbazol-2-yl]thiophen-2-yl]-7-(5-methylthiophen-2-yl)pyrrolo[2,3-f]indole-2,6-dione
CID 158244463
5-[5-[5-(1,3-dioxo-2-pentylisoindol-5-yl)thiophen-2-yl]thiophen-2-yl]-2-pentylisoindole-1,3-dione
CID 132566520
[5-[9-(2-ethylhexyl)-7-(5-trimethylstannylthiophen-2-yl)carbazol-2-yl]thiophen-2-yl]-trimethylstannane
CID 145188905

Frequently Asked Questions

What is the IUPAC name of bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane?
The IUPAC name of bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane (CID 158184278) is bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane.
What is the SMILES notation for bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane?
The canonical SMILES for bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane is C.CCCCCCCCCCC(CCCCCCCCCC)CCCN1C(=O)/C(=C2/C(=O)N(CCCC(CCCCCCCCCC)CCCCCCCCCC)c3cc(-c4ccc(-c5ccc(C)s5)s4)ccc32)c2ccc(C)cc21.CCCCCCCCCCC(CCCCCCCCCC)CCCN1C(=O)/C(=C2/C(=O)N(CCCC(CCCCCCCCCC)CCCCCCCCCC)c3cc(Br)ccc32)c2ccc(Br)cc21.Cc1ccc(-c2ccc([Sn](C)(C)C)s2)s1.PPP.
What is the InChIKey of bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane?
The InChIKey is FYYPCQMRMJRMOC-LYLBMXEOSA-N. The full InChI is InChI=1S/C74H114N2O2S2.C64H104Br2N2O2.C9H7S2.CH4.3CH3.H5P3.Sn/c1-7-11-15-19-23-27-31-35-41-61(42-36-32-28-24-20-16-12-8-2)45-39-55-75-66-57-59(5)47-50-64(66)71(73(75)77)72-65-51-49-63(68-53-54-70(80-68)69-52-48-60(6)79-69)58-67(65)76(74(72)78)56-40-46-62(43-37-33-29-25-21-17-13-9-3)44-38-34-30-26-22-18-14-10-4;1-5-9-13-17-21-25-29-33-39-53(40-34-30-26-22-18-14-10-6-2)43-37-49-67-59-51-55(65)45-47-57(59)61(63(67)69)62-58-48-46-56(66)52-60(58)68(64(62)70)50-38-44-54(41-35-31-27-23-19-15-11-7-3)42-36-32-28-24-20-16-12-8-4;1-7-4-5-9(11-7)8-3-2-6-10-8;;;;;1-3-2;/h47-54,57-58,61-62H,7-46,55-56H2,1-6H3;45-48,51-54H,5-44,49-50H2,1-4H3;2-5H,1H3;1H4;3*1H3;3H,1-2H2;/b72-71+;62-61+;;;;;;;.
What are the key properties of bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane?
bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane has a molecular weight of 2678.34 g/mol, XLogP of 52.22, 92 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis(phosphanyl)phosphane;(3E)-6-bromo-3-[6-bromo-1-(4-decyltetradecyl)-2-oxoindol-3-ylidene]-1-(4-decyltetradecyl)indol-2-one;(3E)-1-(4-decyltetradecyl)-3-[1-(4-decyltetradecyl)-6-[5-(5-methylthiophen-2-yl)thiophen-2-yl]-2-oxoindol-3-ylidene]-6-methylindol-2-one;methane;trimethyl-[5-(5-methylthiophen-2-yl)thiophen-2-yl]stannane is sourced from PubChem (CID 158184278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).