7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine

C55H39GeN3 — CID 164730489

IUPAC7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine
SMILESCC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4ccc5c(c4)[Ge](c4ccccc4)(c4ccccc4)c4c(-c6ccccc6)nc(-c6ccccc6)nc4-5)c3c21
InChIInChI=1S/C55H39GeN3/c1-55(2)46-29-17-15-27-41(46)43-33-34-44-42-28-16-18-30-48(42)59(53(44)49(43)55)40-31-32-45-47(35-40)56(38-23-11-5-12-24-38,39-25-13-6-14-26-39)50-51(36-19-7-3-8-20-36)57-54(58-52(45)50)37-21-9-4-10-22-37/h3-35H,1-2H3
InChIKeyZLVGIWXGHYFMMG-UHFFFAOYSA-N
MW814.55 g/mol
LogP10.57
Rot. Bonds5

About 7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine

7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine (PubChem CID 164730489) has the molecular formula C55H39GeN3 and a molecular weight of 814.55 g/mol. Its IUPAC name is 7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine.

Molecular Properties

Compound Name7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine
PubChem CID164730489
Molecular FormulaC55H39GeN3
Molecular Weight814.55 g/mol
Exact Mass815.24
IUPAC Name7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine
SMILESCC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4ccc5c(c4)[Ge](c4ccccc4)(c4ccccc4)c4c(-c6ccccc6)nc(-c6ccccc6)nc4-5)c3c21
InChIInChI=1S/C55H39GeN3/c1-55(2)46-29-17-15-27-41(46)43-33-34-44-42-28-16-18-30-48(42)59(53(44)49(43)55)40-31-32-45-47(35-40)56(38-23-11-5-12-24-38,39-25-13-6-14-26-39)50-51(36-19-7-3-8-20-36)57-54(58-52(45)50)37-21-9-4-10-22-37/h3-35H,1-2H3
InChIKeyZLVGIWXGHYFMMG-UHFFFAOYSA-N
XLogP10.57
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500814.55
LogP ≤ 510.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine 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

11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole
CID 58059187
2-[3-(11,11-dimethylindeno[1,2-b]carbazol-5-yl)phenyl]-4,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidine
CID 140805545
4-[4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-2,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidine;5-[4-(2,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidin-4-yl)phenyl]-[1]benzothiolo[3,2-c]carbazole;2,5,5-triphenyl-4-[4-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-[1]benzogermolo[3,2-d]pyrimidine
CID 157050001
11-[3-[2,6-bis[4-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)phenyl]quinazolin-4-yl]phenyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[4-[2,4-bis[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[4-[4,6-bis[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)phenyl]quinazolin-2-yl]phenyl]-12,12-dimethylindeno[2,1-a]carbazole
CID 160929846
11-[4-(3,5-diphenylphenyl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole;11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole
CID 158828400
2-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]-4,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidine;4,5,5-triphenyl-2-[3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]-[1]benzogermolo[3,2-d]pyrimidine
CID 158437354
11-[4-[2,6-bis[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)phenyl]pyrimidin-4-yl]phenyl]-12,12-dimethylindeno[2,1-a]carbazole
CID 126630778
4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-2,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidine;5-[4-(2,5,5-triphenyl-[1]benzogermolo[3,2-d]pyrimidin-4-yl)phenyl]-[1]benzofuro[3,2-c]carbazole;2,5,5-triphenyl-4-(12-phenylindolo[3,2-c]carbazol-5-yl)-[1]benzogermolo[3,2-d]pyrimidine
CID 160720044
12,12-dimethyl-11-[3-(4,5,6-trimethylpyrimidin-2-yl)phenyl]indeno[2,1-a]carbazole
CID 139516699
11-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-12,12-dimethylindeno[2,1-a]carbazole
CID 126628967
12,12-dimethyl-11-[4-(4-phenylphenyl)-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]indeno[2,1-a]carbazole
CID 163675425
2-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine
CID 130333806

Frequently Asked Questions

What is the IUPAC name of 7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine?
The IUPAC name of 7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine (CID 164730489) is 7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine.
What is the SMILES notation for 7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine?
The canonical SMILES for 7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine is CC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4ccc5c(c4)[Ge](c4ccccc4)(c4ccccc4)c4c(-c6ccccc6)nc(-c6ccccc6)nc4-5)c3c21.
What is the InChIKey of 7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine?
The InChIKey is ZLVGIWXGHYFMMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H39GeN3/c1-55(2)46-29-17-15-27-41(46)43-33-34-44-42-28-16-18-30-48(42)59(53(44)49(43)55)40-31-32-45-47(35-40)56(38-23-11-5-12-24-38,39-25-13-6-14-26-39)50-51(36-19-7-3-8-20-36)57-54(58-52(45)50)37-21-9-4-10-22-37/h3-35H,1-2H3.
What are the key properties of 7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine?
7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine has a molecular weight of 814.55 g/mol, XLogP of 10.57, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-2,4,5,5-tetraphenyl-[1]benzogermolo[3,2-d]pyrimidine is sourced from PubChem (CID 164730489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).