7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole

C147H99N9 — CID 159989591

IUPAC7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole
SMILESCn1c2ccccc2c2c1ccc1c3ccccc3n(-c3cccc4c3c3ccccc3n4-c3cccc(-c4cccc(-c5ccccc5)c4)c3)c12.Cn1c2ccccc2c2cc3c4ccccc4n(-c4ccc5c6ccccc6n(-c6cccc(-c7cccc(-c8ccccc8)c7)c6)c5c4)c3cc21.Cn1c2ccccc2c2cc3c4ccccc4n(-c4cccc5c6ccccc6n(-c6cccc(-c7cccc(-c8ccccc8)c7)c6)c45)c3cc21
InChIInChI=1S/3C49H33N3/c1-50-41-23-8-6-21-39(41)48-44(50)29-28-38-37-20-5-9-24-42(37)52(49(38)48)46-27-13-26-45-47(46)40-22-7-10-25-43(40)51(45)36-19-12-18-35(31-36)34-17-11-16-33(30-34)32-14-3-2-4-15-32;1-50-43-24-8-5-21-38(43)41-30-42-39-22-7-10-26-45(39)52(48(42)31-47(41)50)46-27-13-23-40-37-20-6-9-25-44(37)51(49(40)46)36-19-12-18-35(29-36)34-17-11-16-33(28-34)32-14-3-2-4-15-32;1-50-44-22-8-5-20-39(44)42-30-43-40-21-7-10-24-46(40)52(49(43)31-47(42)50)37-25-26-41-38-19-6-9-23-45(38)51(48(41)29-37)36-18-12-17-35(28-36)34-16-11-15-33(27-34)32-13-3-2-4-14-32/h3*2-31H,1H3
InChIKeyOGTXPWZZKURGMB-UHFFFAOYSA-N
MW1991.47 g/mol
LogP38.58
Rot. Bonds12

About 7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole

7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole (PubChem CID 159989591) has the molecular formula C147H99N9 and a molecular weight of 1991.47 g/mol. Its IUPAC name is 7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole.

Molecular Properties

Compound Name7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole
PubChem CID159989591
Molecular FormulaC147H99N9
Molecular Weight1991.47 g/mol
Exact Mass1989.80
IUPAC Name7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole
SMILESCn1c2ccccc2c2c1ccc1c3ccccc3n(-c3cccc4c3c3ccccc3n4-c3cccc(-c4cccc(-c5ccccc5)c4)c3)c12.Cn1c2ccccc2c2cc3c4ccccc4n(-c4ccc5c6ccccc6n(-c6cccc(-c7cccc(-c8ccccc8)c7)c6)c5c4)c3cc21.Cn1c2ccccc2c2cc3c4ccccc4n(-c4cccc5c6ccccc6n(-c6cccc(-c7cccc(-c8ccccc8)c7)c6)c45)c3cc21
InChIInChI=1S/3C49H33N3/c1-50-41-23-8-6-21-39(41)48-44(50)29-28-38-37-20-5-9-24-42(37)52(49(38)48)46-27-13-26-45-47(46)40-22-7-10-25-43(40)51(45)36-19-12-18-35(31-36)34-17-11-16-33(30-34)32-14-3-2-4-15-32;1-50-43-24-8-5-21-38(43)41-30-42-39-22-7-10-26-45(39)52(48(42)31-47(41)50)46-27-13-23-40-37-20-6-9-25-44(37)51(49(40)46)36-19-12-18-35(29-36)34-17-11-16-33(28-34)32-14-3-2-4-15-32;1-50-44-22-8-5-20-39(44)42-30-43-40-21-7-10-24-46(40)52(49(43)31-47(42)50)37-25-26-41-38-19-6-9-23-45(38)51(48(41)29-37)36-18-12-17-35(28-36)34-16-11-15-33(27-34)32-13-3-2-4-14-32/h3*2-31H,1H3
InChIKeyOGTXPWZZKURGMB-UHFFFAOYSA-N
XLogP38.58
TPSA44.37 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds12
Heavy Atoms156
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001991.47
LogP ≤ 538.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole?
The IUPAC name of 7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole (CID 159989591) is 7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole.
What is the SMILES notation for 7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole?
The canonical SMILES for 7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole is Cn1c2ccccc2c2c1ccc1c3ccccc3n(-c3cccc4c3c3ccccc3n4-c3cccc(-c4cccc(-c5ccccc5)c4)c3)c12.Cn1c2ccccc2c2cc3c4ccccc4n(-c4ccc5c6ccccc6n(-c6cccc(-c7cccc(-c8ccccc8)c7)c6)c5c4)c3cc21.Cn1c2ccccc2c2cc3c4ccccc4n(-c4cccc5c6ccccc6n(-c6cccc(-c7cccc(-c8ccccc8)c7)c6)c45)c3cc21.
What is the InChIKey of 7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole?
The InChIKey is OGTXPWZZKURGMB-UHFFFAOYSA-N. The full InChI is InChI=1S/3C49H33N3/c1-50-41-23-8-6-21-39(41)48-44(50)29-28-38-37-20-5-9-24-42(37)52(49(38)48)46-27-13-26-45-47(46)40-22-7-10-25-43(40)51(45)36-19-12-18-35(31-36)34-17-11-16-33(30-34)32-14-3-2-4-15-32;1-50-43-24-8-5-21-38(43)41-30-42-39-22-7-10-26-45(39)52(48(42)31-47(41)50)46-27-13-23-40-37-20-6-9-25-44(37)51(49(40)46)36-19-12-18-35(29-36)34-17-11-16-33(28-34)32-14-3-2-4-15-32;1-50-44-22-8-5-20-39(44)42-30-43-40-21-7-10-24-46(40)52(49(43)31-47(42)50)37-25-26-41-38-19-6-9-23-45(38)51(48(41)29-37)36-18-12-17-35(28-36)34-16-11-15-33(27-34)32-13-3-2-4-14-32/h3*2-31H,1H3.
What are the key properties of 7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole?
7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole has a molecular weight of 1991.47 g/mol, XLogP of 38.58, 12 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]indolo[2,3-b]carbazole;7-methyl-5-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]indolo[2,3-b]carbazole;5-methyl-12-[9-[3-(3-phenylphenyl)phenyl]carbazol-4-yl]indolo[3,2-c]carbazole is sourced from PubChem (CID 159989591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).