[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine

C328H227N19O8S3Si5 — CID 165069663

IUPAC[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine
SMILESC.C.[2H]c1c([2H])c([2H])c2c(c1[2H])c1c([2H])c([2H])c([2H])c([2H])c1n2-c1ccc2c(c1)nc1n2-c2ccccc2OC1.[2H]c1c([2H])c([2H])c2c(c1[2H])c1ccccc1n2-c1ccc2c(c1)nc1n2-c2ccccc2OC1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-c3ccc4sc5ccccc5c4c3)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-c3cccc4c3oc3ccccc34)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-c3cccc4c3sc3ccccc34)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-c3cccc4sc5ccccc5c34)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)c2)cc1
InChIInChI=1S/C74H49N5OSi.C50H34N2O2Si.3C50H34N2OSSi.2C26H17N3O.2CH4/c1-3-21-54(22-4-1)81(55-23-5-2-6-24-55,56-25-17-19-49(43-56)50-37-40-71-64(44-50)75-74-48-80-73-36-16-15-35-72(73)79(71)74)57-26-18-20-51(45-57)76-69-41-38-52(77-65-31-11-7-27-58(65)59-28-8-12-32-66(59)77)46-62(69)63-47-53(39-42-70(63)76)78-67-33-13-9-29-60(67)61-30-10-14-34-68(61)78;1-3-16-37(17-4-1)55(38-18-5-2-6-19-38,40-21-12-15-36(31-40)41-23-13-24-43-42-22-7-9-26-47(42)54-50(41)43)39-20-11-14-34(30-39)35-28-29-45-44(32-35)51-49-33-53-48-27-10-8-25-46(48)52(45)49;1-3-16-37(17-4-1)55(38-18-5-2-6-19-38,40-21-12-15-36(31-40)41-23-13-24-43-42-22-7-10-27-48(42)54-50(41)43)39-20-11-14-34(30-39)35-28-29-45-44(32-35)51-49-33-53-47-26-9-8-25-46(47)52(45)49;1-3-16-37(17-4-1)55(38-18-5-2-6-19-38,40-21-12-15-36(31-40)41-23-13-27-48-50(41)42-22-7-10-26-47(42)54-48)39-20-11-14-34(30-39)35-28-29-44-43(32-35)51-49-33-53-46-25-9-8-24-45(46)52(44)49;1-3-15-38(16-4-1)55(39-17-5-2-6-18-39,40-19-11-13-34(29-40)36-26-28-49-43(31-36)42-21-7-10-24-48(42)54-49)41-20-12-14-35(30-41)37-25-27-45-44(32-37)51-50-33-53-47-23-9-8-22-46(47)52(45)50;2*1-3-9-21-18(7-1)19-8-2-4-10-22(19)28(21)17-13-14-23-20(15-17)27-26-16-30-25-12-6-5-11-24(25)29(23)26;;/h1-47H,48H2;4*1-32H,33H2;2*1-15H,16H2;2*1H4/i;;;;;1D,2D,3D,4D,7D,8D,9D,10D;1D,3D,7D,9D;;
InChIKeySNXZIABVTLFHKF-VHTWALPOSA-N
MW4811.25 g/mol
LogP68.08
Rot. Bonds34

About [3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine

[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine (PubChem CID 165069663) has the molecular formula C328H227N19O8S3Si5 and a molecular weight of 4811.25 g/mol. Its IUPAC name is [3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine.

Molecular Properties

Compound Name[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine
PubChem CID165069663
Molecular FormulaC328H227N19O8S3Si5
Molecular Weight4811.25 g/mol
Exact Mass4806.67
IUPAC Name[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine
SMILESC.C.[2H]c1c([2H])c([2H])c2c(c1[2H])c1c([2H])c([2H])c([2H])c([2H])c1n2-c1ccc2c(c1)nc1n2-c2ccccc2OC1.[2H]c1c([2H])c([2H])c2c(c1[2H])c1ccccc1n2-c1ccc2c(c1)nc1n2-c2ccccc2OC1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-c3ccc4sc5ccccc5c4c3)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-c3cccc4c3oc3ccccc34)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-c3cccc4c3sc3ccccc34)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-c3cccc4sc5ccccc5c34)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)c2)cc1
InChIInChI=1S/C74H49N5OSi.C50H34N2O2Si.3C50H34N2OSSi.2C26H17N3O.2CH4/c1-3-21-54(22-4-1)81(55-23-5-2-6-24-55,56-25-17-19-49(43-56)50-37-40-71-64(44-50)75-74-48-80-73-36-16-15-35-72(73)79(71)74)57-26-18-20-51(45-57)76-69-41-38-52(77-65-31-11-7-27-58(65)59-28-8-12-32-66(59)77)46-62(69)63-47-53(39-42-70(63)76)78-67-33-13-9-29-60(67)61-30-10-14-34-68(61)78;1-3-16-37(17-4-1)55(38-18-5-2-6-19-38,40-21-12-15-36(31-40)41-23-13-24-43-42-22-7-9-26-47(42)54-50(41)43)39-20-11-14-34(30-39)35-28-29-45-44(32-35)51-49-33-53-48-27-10-8-25-46(48)52(45)49;1-3-16-37(17-4-1)55(38-18-5-2-6-19-38,40-21-12-15-36(31-40)41-23-13-24-43-42-22-7-10-27-48(42)54-50(41)43)39-20-11-14-34(30-39)35-28-29-45-44(32-35)51-49-33-53-47-26-9-8-25-46(47)52(45)49;1-3-16-37(17-4-1)55(38-18-5-2-6-19-38,40-21-12-15-36(31-40)41-23-13-27-48-50(41)42-22-7-10-26-47(42)54-48)39-20-11-14-34(30-39)35-28-29-44-43(32-35)51-49-33-53-46-25-9-8-24-45(46)52(44)49;1-3-15-38(16-4-1)55(39-17-5-2-6-18-39,40-19-11-13-34(29-40)36-26-28-49-43(31-36)42-21-7-10-24-48(42)54-49)41-20-12-14-35(30-41)37-25-27-45-44(32-37)51-50-33-53-47-23-9-8-22-46(47)52(45)50;2*1-3-9-21-18(7-1)19-8-2-4-10-22(19)28(21)17-13-14-23-20(15-17)27-26-16-30-25-12-6-5-11-24(25)29(23)26;;/h1-47H,48H2;4*1-32H,33H2;2*1-15H,16H2;2*1H4/i;;;;;1D,2D,3D,4D,7D,8D,9D,10D;1D,3D,7D,9D;;
InChIKeySNXZIABVTLFHKF-VHTWALPOSA-N
XLogP68.08
TPSA227.14 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds34
Heavy Atoms363
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004811.25
LogP ≤ 568.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze [3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of [3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine?
The IUPAC name of [3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine (CID 165069663) is [3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine.
What is the SMILES notation for [3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine?
The canonical SMILES for [3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine is C.C.[2H]c1c([2H])c([2H])c2c(c1[2H])c1c([2H])c([2H])c([2H])c([2H])c1n2-c1ccc2c(c1)nc1n2-c2ccccc2OC1.[2H]c1c([2H])c([2H])c2c(c1[2H])c1ccccc1n2-c1ccc2c(c1)nc1n2-c2ccccc2OC1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-c3ccc4sc5ccccc5c4c3)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-c3cccc4c3oc3ccccc34)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-c3cccc4c3sc3ccccc34)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-c3cccc4sc5ccccc5c34)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4c(c3)nc3n4-c4ccccc4OC3)c2)c2cccc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)c2)cc1.
What is the InChIKey of [3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine?
The InChIKey is SNXZIABVTLFHKF-VHTWALPOSA-N. The full InChI is InChI=1S/C74H49N5OSi.C50H34N2O2Si.3C50H34N2OSSi.2C26H17N3O.2CH4/c1-3-21-54(22-4-1)81(55-23-5-2-6-24-55,56-25-17-19-49(43-56)50-37-40-71-64(44-50)75-74-48-80-73-36-16-15-35-72(73)79(71)74)57-26-18-20-51(45-57)76-69-41-38-52(77-65-31-11-7-27-58(65)59-28-8-12-32-66(59)77)46-62(69)63-47-53(39-42-70(63)76)78-67-33-13-9-29-60(67)61-30-10-14-34-68(61)78;1-3-16-37(17-4-1)55(38-18-5-2-6-19-38,40-21-12-15-36(31-40)41-23-13-24-43-42-22-7-9-26-47(42)54-50(41)43)39-20-11-14-34(30-39)35-28-29-45-44(32-35)51-49-33-53-48-27-10-8-25-46(48)52(45)49;1-3-16-37(17-4-1)55(38-18-5-2-6-19-38,40-21-12-15-36(31-40)41-23-13-24-43-42-22-7-10-27-48(42)54-50(41)43)39-20-11-14-34(30-39)35-28-29-45-44(32-35)51-49-33-53-47-26-9-8-25-46(47)52(45)49;1-3-16-37(17-4-1)55(38-18-5-2-6-19-38,40-21-12-15-36(31-40)41-23-13-27-48-50(41)42-22-7-10-26-47(42)54-48)39-20-11-14-34(30-39)35-28-29-44-43(32-35)51-49-33-53-46-25-9-8-24-45(46)52(44)49;1-3-15-38(16-4-1)55(39-17-5-2-6-18-39,40-19-11-13-34(29-40)36-26-28-49-43(31-36)42-21-7-10-24-48(42)54-49)41-20-12-14-35(30-41)37-25-27-45-44(32-37)51-50-33-53-47-23-9-8-22-46(47)52(45)50;2*1-3-9-21-18(7-1)19-8-2-4-10-22(19)28(21)17-13-14-23-20(15-17)27-26-16-30-25-12-6-5-11-24(25)29(23)26;;/h1-47H,48H2;4*1-32H,33H2;2*1-15H,16H2;2*1H4/i;;;;;1D,2D,3D,4D,7D,8D,9D,10D;1D,3D,7D,9D;;.
What are the key properties of [3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine?
[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine has a molecular weight of 4811.25 g/mol, XLogP of 68.08, 34 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzofuran-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-1-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-2-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-(3-dibenzothiophen-4-ylphenyl)-diphenylsilane;[3-(6H-benzimidazolo[2,1-c][1,4]benzoxazin-9-yl)phenyl]-[3-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-diphenylsilane;methane;9-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine;9-(1,2,3,4-tetradeuteriocarbazol-9-yl)-6H-benzimidazolo[2,1-c][1,4]benzoxazine is sourced from PubChem (CID 165069663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).