N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine

C150H98N14O2 — CID 162013324

IUPACN-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-n4c5ccccc5c5ccc6oc7ccccc7c6c54)cc3)c3ncc(-c4ccccc4)cn3)cc2)cc1.c1ccc(-c2cnc(N(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccc4c(c3)c3ccc5oc6ccccc6c5c3n4-c3ccccc3)nc2)cc1.c1ccc(-c2cnc(N(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccc4c(c3)c3ccccc3n4-c3cccc(-c4ccccc4)c3)nc2)cc1
InChIInChI=1S/C52H33N5O.C52H35N5.C46H30N4O/c1-4-14-34(15-5-1)35-32-53-52(54-33-35)55(38-24-27-46-43(30-38)40-20-10-12-22-45(40)56(46)36-16-6-2-7-17-36)39-25-28-47-44(31-39)41-26-29-49-50(42-21-11-13-23-48(42)58-49)51(41)57(47)37-18-8-3-9-19-37;1-4-15-36(16-5-1)38-19-14-22-41(31-38)57-49-26-13-11-24-45(49)47-33-43(28-30-51(47)57)55(52-53-34-39(35-54-52)37-17-6-2-7-18-37)42-27-29-50-46(32-42)44-23-10-12-25-48(44)56(50)40-20-8-3-9-21-40;1-3-11-31(12-4-1)33-19-21-35(22-20-33)49(46-47-29-34(30-48-46)32-13-5-2-6-14-32)36-23-25-37(26-24-36)50-41-17-9-7-15-38(41)39-27-28-43-44(45(39)50)40-16-8-10-18-42(40)51-43/h1-33H;1-35H;1-30H
InChIKeyYTTQRTCPXVXMGC-UHFFFAOYSA-N
MW2128.53 g/mol
LogP39.46
Rot. Bonds19

About N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine

N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine (PubChem CID 162013324) has the molecular formula C150H98N14O2 and a molecular weight of 2128.53 g/mol. Its IUPAC name is N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine.

Molecular Properties

Compound NameN-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine
PubChem CID162013324
Molecular FormulaC150H98N14O2
Molecular Weight2128.53 g/mol
Exact Mass2126.80
IUPAC NameN-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-n4c5ccccc5c5ccc6oc7ccccc7c6c54)cc3)c3ncc(-c4ccccc4)cn3)cc2)cc1.c1ccc(-c2cnc(N(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccc4c(c3)c3ccc5oc6ccccc6c5c3n4-c3ccccc3)nc2)cc1.c1ccc(-c2cnc(N(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccc4c(c3)c3ccccc3n4-c3cccc(-c4ccccc4)c3)nc2)cc1
InChIInChI=1S/C52H33N5O.C52H35N5.C46H30N4O/c1-4-14-34(15-5-1)35-32-53-52(54-33-35)55(38-24-27-46-43(30-38)40-20-10-12-22-45(40)56(46)36-16-6-2-7-17-36)39-25-28-47-44(31-39)41-26-29-49-50(42-21-11-13-23-48(42)58-49)51(41)57(47)37-18-8-3-9-19-37;1-4-15-36(16-5-1)38-19-14-22-41(31-38)57-49-26-13-11-24-45(49)47-33-43(28-30-51(47)57)55(52-53-34-39(35-54-52)37-17-6-2-7-18-37)42-27-29-50-46(32-42)44-23-10-12-25-48(44)56(50)40-20-8-3-9-21-40;1-3-11-31(12-4-1)33-19-21-35(22-20-33)49(46-47-29-34(30-48-46)32-13-5-2-6-14-32)36-23-25-37(26-24-36)50-41-17-9-7-15-38(41)39-27-28-43-44(45(39)50)40-16-8-10-18-42(40)51-43/h1-33H;1-35H;1-30H
InChIKeyYTTQRTCPXVXMGC-UHFFFAOYSA-N
XLogP39.46
TPSA137.99 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds19
Heavy Atoms166
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002128.53
LogP ≤ 539.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine 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

N,9-bis(4-phenylphenyl)-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine;9-dibenzofuran-2-yl-N-(4-phenylphenyl)-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine;9-(3-phenylphenyl)-N-(4-phenylphenyl)-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine
CID 159873005
N-(5-dibenzofuran-3-ylpyrimidin-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 155139580
9-phenyl-N-(4-phenylphenyl)-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine
CID 155139579
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-4-(4-phenylphenyl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(8-phenyldibenzofuran-2-yl)phenyl]-4-(4-phenylphenyl)aniline;9-phenyl-N-[4-(8-phenyldibenzofuran-2-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine
CID 158901637
N-(4-naphthalen-2-ylphenyl)-9-phenyl-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine;9-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)carbazol-2-amine;9-phenyl-N-(4-phenylphenyl)-N-[5-(4-phenylphenyl)pyrimidin-2-yl]carbazol-3-amine
CID 157279634
N-[4-(9,21-dioxahexacyclo[11.11.0.02,10.03,8.014,22.015,20]tetracosa-1(13),2(10),3(8),4,6,11,14(22),15,17,19,23-undecaen-6-yl)phenyl]-N,9-diphenylcarbazol-3-amine
CID 162697693
12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 122598858
N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-2-amine
CID 118462582
N-dibenzofuran-2-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;4-phenyl-N,N-bis[4-(9-phenylcarbazol-3-yl)phenyl]aniline;N-phenyl-4-(9-phenylcarbazol-3-yl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 158933576
5-(9-dibenzofuran-2-ylcarbazol-3-yl)-12-(3-phenylphenyl)indolo[3,2-c]carbazole
CID 170268239
N-(4-naphtho[2,1-b][1]benzofuran-3-ylphenyl)-9-phenyl-N-(3-phenylphenyl)carbazol-3-amine
CID 170033937
N-[3-(3-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)dibenzofuran-2-amine
CID 121260620

Frequently Asked Questions

What is the IUPAC name of N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine?
The IUPAC name of N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine (CID 162013324) is N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine.
What is the SMILES notation for N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine?
The canonical SMILES for N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine is c1ccc(-c2ccc(N(c3ccc(-n4c5ccccc5c5ccc6oc7ccccc7c6c54)cc3)c3ncc(-c4ccccc4)cn3)cc2)cc1.c1ccc(-c2cnc(N(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccc4c(c3)c3ccc5oc6ccccc6c5c3n4-c3ccccc3)nc2)cc1.c1ccc(-c2cnc(N(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccc4c(c3)c3ccccc3n4-c3cccc(-c4ccccc4)c3)nc2)cc1.
What is the InChIKey of N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine?
The InChIKey is YTTQRTCPXVXMGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H33N5O.C52H35N5.C46H30N4O/c1-4-14-34(15-5-1)35-32-53-52(54-33-35)55(38-24-27-46-43(30-38)40-20-10-12-22-45(40)56(46)36-16-6-2-7-17-36)39-25-28-47-44(31-39)41-26-29-49-50(42-21-11-13-23-48(42)58-49)51(41)57(47)37-18-8-3-9-19-37;1-4-15-36(16-5-1)38-19-14-22-41(31-38)57-49-26-13-11-24-45(49)47-33-43(28-30-51(47)57)55(52-53-34-39(35-54-52)37-17-6-2-7-18-37)42-27-29-50-46(32-42)44-23-10-12-25-48(44)56(50)40-20-8-3-9-21-40;1-3-11-31(12-4-1)33-19-21-35(22-20-33)49(46-47-29-34(30-48-46)32-13-5-2-6-14-32)36-23-25-37(26-24-36)50-41-17-9-7-15-38(41)39-27-28-43-44(45(39)50)40-16-8-10-18-42(40)51-43/h1-33H;1-35H;1-30H.
What are the key properties of N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine?
N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine has a molecular weight of 2128.53 g/mol, XLogP of 39.46, 19 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-5-phenyl-N-(4-phenylphenyl)pyrimidin-2-amine;12-phenyl-N-(9-phenylcarbazol-3-yl)-N-(5-phenylpyrimidin-2-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;9-phenyl-N-[9-(3-phenylphenyl)carbazol-3-yl]-N-(5-phenylpyrimidin-2-yl)carbazol-3-amine is sourced from PubChem (CID 162013324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).