9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine

C248H147N31 — CID 158316941

IUPAC9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine
SMILES[C-]#[N+]c1cc(-c2cc(-c3ccccc3[N+]#[C-])nc(-c3ccccc3[N+]#[C-])n2)c(C)cc1-c1ccc(-c2ccc(-n3c4ccccc4c4cc(N(c5ccccc5)c5ccccc5)ccc43)cc2)cc1.[C-]#[N+]c1cc(-c2ccc(-c3cc(-c4ccccc4[N+]#[C-])nc(-c4ccccc4[N+]#[C-])n3)cc2)c(C#N)cc1-c1ccc(-n2c3ccccc3c3cc(N(c4ccccc4)c4ccccc4)ccc32)cc1.[C-]#[N+]c1ccc(N(c2ccc([N+]#[C-])cc2)c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccc(-c4ccc(-c5cc(-c6ccccc6[N+]#[C-])nc(-c6ccccc6[N+]#[C-])n5)cc4)cc3)cc2)cc1.[C-]#[N+]c1cccc(-c2cc(-c3ccc(-c4ccc(-c5cc([N+]#[C-])c(-n6c7ccccc7c7cc(N(c8ccccc8)c8ccccc8)ccc76)cc5C#N)cc4)cc3)nc(-c3cccc([N+]#[C-])c3)n2)c1
InChIInChI=1S/3C62H36N8.C62H39N7/c1-63-46-27-33-48(34-28-46)69(49-35-29-47(64-2)30-36-49)51-37-38-61-55(39-51)52-11-7-10-16-60(52)70(61)50-31-25-44(26-32-50)42-19-17-41(18-20-42)43-21-23-45(24-22-43)58-40-59(53-12-5-8-14-56(53)65-3)68-62(67-58)54-13-6-9-15-57(54)66-4;1-64-55-23-13-10-21-50(55)59-39-57(67-62(68-59)51-22-11-14-24-56(51)65-2)43-28-26-41(27-29-43)52-38-58(66-3)53(36-44(52)40-63)42-30-32-47(33-31-42)70-60-25-15-12-20-49(60)54-37-48(34-35-61(54)70)69(45-16-6-4-7-17-45)46-18-8-5-9-19-46;1-64-48-16-12-14-45(34-48)57-39-56(67-62(68-57)46-15-13-17-49(35-46)65-2)44-30-26-42(27-31-44)41-24-28-43(29-25-41)54-38-58(66-3)61(36-47(54)40-63)70-59-23-11-10-22-53(59)55-37-52(32-33-60(55)70)69(50-18-6-4-7-19-50)51-20-8-5-9-21-51;1-41-37-53(57(65-4)39-52(41)59-40-58(50-22-11-14-24-55(50)63-2)66-62(67-59)51-23-12-15-25-56(51)64-3)44-29-27-42(28-30-44)43-31-33-47(34-32-43)69-60-26-16-13-21-49(60)54-38-48(35-36-61(54)69)68(45-17-7-5-8-18-45)46-19-9-6-10-20-46/h5-40H;2*4-39H;5-40H,1H3
InChIKeyGOJHYROFKXAICS-UHFFFAOYSA-N
MW3561.12 g/mol
LogP68.73
Rot. Bonds36

About 9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine

9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine (PubChem CID 158316941) has the molecular formula C248H147N31 and a molecular weight of 3561.12 g/mol. Its IUPAC name is 9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine.

Molecular Properties

Compound Name9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine
PubChem CID158316941
Molecular FormulaC248H147N31
Molecular Weight3561.12 g/mol
Exact Mass3558.25
IUPAC Name9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine
SMILES[C-]#[N+]c1cc(-c2cc(-c3ccccc3[N+]#[C-])nc(-c3ccccc3[N+]#[C-])n2)c(C)cc1-c1ccc(-c2ccc(-n3c4ccccc4c4cc(N(c5ccccc5)c5ccccc5)ccc43)cc2)cc1.[C-]#[N+]c1cc(-c2ccc(-c3cc(-c4ccccc4[N+]#[C-])nc(-c4ccccc4[N+]#[C-])n3)cc2)c(C#N)cc1-c1ccc(-n2c3ccccc3c3cc(N(c4ccccc4)c4ccccc4)ccc32)cc1.[C-]#[N+]c1ccc(N(c2ccc([N+]#[C-])cc2)c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccc(-c4ccc(-c5cc(-c6ccccc6[N+]#[C-])nc(-c6ccccc6[N+]#[C-])n5)cc4)cc3)cc2)cc1.[C-]#[N+]c1cccc(-c2cc(-c3ccc(-c4ccc(-c5cc([N+]#[C-])c(-n6c7ccccc7c7cc(N(c8ccccc8)c8ccccc8)ccc76)cc5C#N)cc4)cc3)nc(-c3cccc([N+]#[C-])c3)n2)c1
InChIInChI=1S/3C62H36N8.C62H39N7/c1-63-46-27-33-48(34-28-46)69(49-35-29-47(64-2)30-36-49)51-37-38-61-55(39-51)52-11-7-10-16-60(52)70(61)50-31-25-44(26-32-50)42-19-17-41(18-20-42)43-21-23-45(24-22-43)58-40-59(53-12-5-8-14-56(53)65-3)68-62(67-58)54-13-6-9-15-57(54)66-4;1-64-55-23-13-10-21-50(55)59-39-57(67-62(68-59)51-22-11-14-24-56(51)65-2)43-28-26-41(27-29-43)52-38-58(66-3)53(36-44(52)40-63)42-30-32-47(33-31-42)70-60-25-15-12-20-49(60)54-37-48(34-35-61(54)70)69(45-16-6-4-7-17-45)46-18-8-5-9-19-46;1-64-48-16-12-14-45(34-48)57-39-56(67-62(68-57)46-15-13-17-49(35-46)65-2)44-30-26-42(27-31-44)41-24-28-43(29-25-41)54-38-58(66-3)61(36-47(54)40-63)70-59-23-11-10-22-53(59)55-37-52(32-33-60(55)70)69(50-18-6-4-7-19-50)51-20-8-5-9-21-51;1-41-37-53(57(65-4)39-52(41)59-40-58(50-22-11-14-24-55(50)63-2)66-62(67-59)51-23-12-15-25-56(51)64-3)44-29-27-42(28-30-44)43-31-33-47(34-32-43)69-60-26-16-13-21-49(60)54-38-48(35-36-61(54)69)68(45-17-7-5-8-18-45)46-19-9-6-10-20-46/h5-40H;2*4-39H;5-40H,1H3
InChIKeyGOJHYROFKXAICS-UHFFFAOYSA-N
XLogP68.73
TPSA240.06 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds36
Heavy Atoms279
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003561.12
LogP ≤ 568.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine with MolForge

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Related Compounds

2-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]-5-[4-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]phenyl]benzonitrile;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-5-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-4-isocyanobenzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-2-isocyano-6-methylphenyl]-3-carbazol-9-ylcarbazole
CID 160759603
9-[4-[4-[4-[2-(2-isocyanophenyl)-6-phenylpyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine
CID 140779758
4-(N-[9-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]carbazol-3-yl]-4-isocyanoanilino)benzonitrile
CID 140779389
2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-5-[4-[3-(4-isocyano-N-(4-isocyanophenyl)anilino)carbazol-9-yl]phenyl]benzonitrile
CID 140779542
2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-5-[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-4-isocyanobenzonitrile
CID 140779345
2-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]-5-[3,6-bis(N-phenylanilino)carbazol-9-yl]benzonitrile
CID 140779572
9-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-3-carbazol-9-ylcarbazole;9-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]-3-carbazol-9-ylcarbazole;4-[6-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-2-(4-cyanophenyl)pyrimidin-4-yl]benzonitrile
CID 161166104
2-[4-[2,6-bis(2-cyanophenyl)pyrimidin-4-yl]phenyl]-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzene-1,4-dicarbonitrile
CID 126734493
5-[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-isocyanobenzonitrile
CID 140779438
9-[4-[4-(2,6-diphenylpyrimidin-4-yl)-2,5-dimethylphenyl]phenyl]-N,N-diphenylcarbazol-3-amine
CID 126730642
9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-2,6-dimethylphenyl]-N,N-diphenylcarbazol-3-amine
CID 140779531
2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-5-[3,6-bis(N-phenylanilino)carbazol-9-yl]benzene-1,3-dicarbonitrile
CID 140779485

Frequently Asked Questions

What is the IUPAC name of 9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine?
The IUPAC name of 9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine (CID 158316941) is 9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine.
What is the SMILES notation for 9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine?
The canonical SMILES for 9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine is [C-]#[N+]c1cc(-c2cc(-c3ccccc3[N+]#[C-])nc(-c3ccccc3[N+]#[C-])n2)c(C)cc1-c1ccc(-c2ccc(-n3c4ccccc4c4cc(N(c5ccccc5)c5ccccc5)ccc43)cc2)cc1.[C-]#[N+]c1cc(-c2ccc(-c3cc(-c4ccccc4[N+]#[C-])nc(-c4ccccc4[N+]#[C-])n3)cc2)c(C#N)cc1-c1ccc(-n2c3ccccc3c3cc(N(c4ccccc4)c4ccccc4)ccc32)cc1.[C-]#[N+]c1ccc(N(c2ccc([N+]#[C-])cc2)c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccc(-c4ccc(-c5cc(-c6ccccc6[N+]#[C-])nc(-c6ccccc6[N+]#[C-])n5)cc4)cc3)cc2)cc1.[C-]#[N+]c1cccc(-c2cc(-c3ccc(-c4ccc(-c5cc([N+]#[C-])c(-n6c7ccccc7c7cc(N(c8ccccc8)c8ccccc8)ccc76)cc5C#N)cc4)cc3)nc(-c3cccc([N+]#[C-])c3)n2)c1.
What is the InChIKey of 9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine?
The InChIKey is GOJHYROFKXAICS-UHFFFAOYSA-N. The full InChI is InChI=1S/3C62H36N8.C62H39N7/c1-63-46-27-33-48(34-28-46)69(49-35-29-47(64-2)30-36-49)51-37-38-61-55(39-51)52-11-7-10-16-60(52)70(61)50-31-25-44(26-32-50)42-19-17-41(18-20-42)43-21-23-45(24-22-43)58-40-59(53-12-5-8-14-56(53)65-3)68-62(67-58)54-13-6-9-15-57(54)66-4;1-64-55-23-13-10-21-50(55)59-39-57(67-62(68-59)51-22-11-14-24-56(51)65-2)43-28-26-41(27-29-43)52-38-58(66-3)53(36-44(52)40-63)42-30-32-47(33-31-42)70-60-25-15-12-20-49(60)54-37-48(34-35-61(54)70)69(45-16-6-4-7-17-45)46-18-8-5-9-19-46;1-64-48-16-12-14-45(34-48)57-39-56(67-62(68-57)46-15-13-17-49(35-46)65-2)44-30-26-42(27-31-44)41-24-28-43(29-25-41)54-38-58(66-3)61(36-47(54)40-63)70-59-23-11-10-22-53(59)55-37-52(32-33-60(55)70)69(50-18-6-4-7-19-50)51-20-8-5-9-21-51;1-41-37-53(57(65-4)39-52(41)59-40-58(50-22-11-14-24-55(50)63-2)66-62(67-59)51-23-12-15-25-56(51)64-3)44-29-27-42(28-30-44)43-31-33-47(34-32-43)69-60-26-16-13-21-49(60)54-38-48(35-36-61(54)69)68(45-17-7-5-8-18-45)46-19-9-6-10-20-46/h5-40H;2*4-39H;5-40H,1H3.
What are the key properties of 9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine?
9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine has a molecular weight of 3561.12 g/mol, XLogP of 68.73, 36 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]-2-isocyano-5-methylphenyl]phenyl]phenyl]-N,N-diphenylcarbazol-3-amine;2-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]-4-isocyano-5-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]benzonitrile;2-[4-[4-[2,6-bis(3-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]-4-isocyano-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;9-[4-[4-[4-[2,6-bis(2-isocyanophenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]-N,N-bis(4-isocyanophenyl)carbazol-3-amine is sourced from PubChem (CID 158316941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).