11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole

C53H38N4 — CID 163450168

IUPAC11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole
SMILESCc1ccccc1C1=CC=C[C@H](c2ccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccc(-c4cccc(-c5ccccc5)n4)cc3)cc2)N1
InChIInChI=1S/C53H38N4/c1-35-13-5-6-16-41(35)49-22-12-21-48(55-49)38-27-31-40(32-28-38)57-51-24-10-8-18-43(51)45-33-52-44(34-53(45)57)42-17-7-9-23-50(42)56(52)39-29-25-37(26-30-39)47-20-11-19-46(54-47)36-14-3-2-4-15-36/h2-34,48,55H,1H3/t48-/m1/s1
InChIKeyBFXSUVHRUYOPOK-QSCHNALKSA-N
MW730.92 g/mol
LogP13.16
Rot. Bonds6

About 11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole

11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole (PubChem CID 163450168) has the molecular formula C53H38N4 and a molecular weight of 730.92 g/mol. Its IUPAC name is 11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole.

Molecular Properties

Compound Name11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole
PubChem CID163450168
Molecular FormulaC53H38N4
Molecular Weight730.92 g/mol
Exact Mass730.31
IUPAC Name11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole
SMILESCc1ccccc1C1=CC=C[C@H](c2ccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccc(-c4cccc(-c5ccccc5)n4)cc3)cc2)N1
InChIInChI=1S/C53H38N4/c1-35-13-5-6-16-41(35)49-22-12-21-48(55-49)38-27-31-40(32-28-38)57-51-24-10-8-18-43(51)45-33-52-44(34-53(45)57)42-17-7-9-23-50(42)56(52)39-29-25-37(26-30-39)47-20-11-19-46(54-47)36-14-3-2-4-15-36/h2-34,48,55H,1H3/t48-/m1/s1
InChIKeyBFXSUVHRUYOPOK-QSCHNALKSA-N
XLogP13.16
TPSA34.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500730.92
LogP ≤ 513.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole 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

3-carbazol-9-yl-9-[4-[2-(2-methylphenyl)-6-phenylpyrimidin-4-yl]phenyl]carbazole
CID 126730487
3-[9-(2-phenyl-1,2-dihydropyridin-6-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 118312822
5-phenyl-11-(6-phenyl-2-pyridinyl)indolo[3,2-b]carbazole
CID 58570053
9-phenyl-3-[6-(9-phenylcarbazol-3-yl)-2-pyridinyl]carbazole
CID 58750690
11-carbazol-9-yl-5-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]indolo[3,2-b]carbazole
CID 121385495
2,6-bis[3-(2-methylphenyl)carbazol-9-yl]-4-(6-phenyl-2-pyridinyl)benzonitrile
CID 155216720
9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-[3-methyl-4-(2-methylphenyl)phenyl]carbazole
CID 118034718
7-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-5-phenyl-7H-indeno[2,1-b]carbazole
CID 126753657
9-[4-[3-[6-[3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]phenyl]-2-pyridinyl]phenyl]phenyl]carbazole
CID 58943592
5-phenyl-11-[4-(4-phenylphenyl)phenyl]indolo[3,2-b]carbazole
CID 142356573
12-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-22-phenyl-12,22-diazahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene
CID 118502133
11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-(4-phenylphenyl)indolo[3,2-b]carbazole
CID 139481204

Frequently Asked Questions

What is the IUPAC name of 11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole?
The IUPAC name of 11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole (CID 163450168) is 11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole.
What is the SMILES notation for 11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole?
The canonical SMILES for 11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole is Cc1ccccc1C1=CC=C[C@H](c2ccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccc(-c4cccc(-c5ccccc5)n4)cc3)cc2)N1.
What is the InChIKey of 11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole?
The InChIKey is BFXSUVHRUYOPOK-QSCHNALKSA-N. The full InChI is InChI=1S/C53H38N4/c1-35-13-5-6-16-41(35)49-22-12-21-48(55-49)38-27-31-40(32-28-38)57-51-24-10-8-18-43(51)45-33-52-44(34-53(45)57)42-17-7-9-23-50(42)56(52)39-29-25-37(26-30-39)47-20-11-19-46(54-47)36-14-3-2-4-15-36/h2-34,48,55H,1H3/t48-/m1/s1.
What are the key properties of 11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole?
11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole has a molecular weight of 730.92 g/mol, XLogP of 13.16, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[4-[(2R)-6-(2-methylphenyl)-1,2-dihydropyridin-2-yl]phenyl]-5-[4-(6-phenyl-2-pyridinyl)phenyl]indolo[3,2-b]carbazole is sourced from PubChem (CID 163450168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).