10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole

C27H20BrN — CID 122470341

IUPAC10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole
SMILESCC1(C)c2ccc(Br)cc2-c2cc3c4ccccc4n(-c4ccccc4)c3cc21
InChIInChI=1S/C27H20BrN/c1-27(2)23-13-12-17(28)14-20(23)21-15-22-19-10-6-7-11-25(19)29(26(22)16-24(21)27)18-8-4-3-5-9-18/h3-16H,1-2H3
InChIKeyYLUGBWSGGDKAHV-UHFFFAOYSA-N
MW438.37 g/mol
LogP7.85
Rot. Bonds1

About 10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole

10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole (PubChem CID 122470341) has the molecular formula C27H20BrN and a molecular weight of 438.37 g/mol. Its IUPAC name is 10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole.

Molecular Properties

Compound Name10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole
PubChem CID122470341
Molecular FormulaC27H20BrN
Molecular Weight438.37 g/mol
Exact Mass437.08
IUPAC Name10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole
SMILESCC1(C)c2ccc(Br)cc2-c2cc3c4ccccc4n(-c4ccccc4)c3cc21
InChIInChI=1S/C27H20BrN/c1-27(2)23-13-12-17(28)14-20(23)21-15-22-19-10-6-7-11-25(19)29(26(22)16-24(21)27)18-8-4-3-5-9-18/h3-16H,1-2H3
InChIKeyYLUGBWSGGDKAHV-UHFFFAOYSA-N
XLogP7.85
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500438.37
LogP ≤ 57.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 10-bromo-7,7-dimethyl-5-phenylindeno[2,1-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

15-[4-(11,11-dimethyl-25-phenyl-15,25-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.019,24]heptacosa-1(16),2,4(12),5,7,9,13,17,19,21,23,26-dodecaen-15-yl)phenyl]-11,11-dimethyl-25-phenyl-15,25-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.019,24]heptacosa-1(16),2,4(12),5,7,9,13,17,19,21,23,26-dodecaene
CID 89492388
7,7-dimethyl-5-(9-phenylcarbazol-2-yl)indeno[2,1-b]carbazole
CID 89472164
2-carbazol-9-yl-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole
CID 139504500
11,11-dimethyl-5-phenylindeno[1,2-b]carbazole
CID 58059223
24,24-dimethyl-20-(4-phenylphenyl)-20-azaheptacyclo[19.11.0.02,7.08,13.014,19.023,31.025,30]dotriaconta-1(32),2,4,6,8,10,12,14,16,18,21,23(31),25,27,29-pentadecaene
CID 142363377
7,7-dimethyl-2,5-bis(9-phenylcarbazol-3-yl)indeno[2,1-b]carbazole
CID 89472025
5-[3,5-bis(9-phenylcarbazol-3-yl)phenyl]-7,7-dimethylindeno[2,1-b]carbazole
CID 146534738
7,7-dimethyl-5-pyridin-4-ylindeno[2,1-b]carbazole
CID 66805075
3-bromo-9-(9,9-dimethylfluoren-2-yl)carbazole
CID 89472048
5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole
CID 66805252
2-carbazol-9-yl-7,7-dimethyl-5-(4-phenylphenyl)indeno[2,1-b]carbazole;7,7-dimethyl-2-[4-(9-phenylcarbazol-3-yl)phenyl]-5-(4-phenylphenyl)indeno[2,1-b]carbazole
CID 159588417
15,15-dimethyl-11,19-diphenyl-11,19-diazaheptacyclo[14.12.0.02,14.04,12.05,10.018,27.020,26]octacosa-1(16),2(14),3,5,7,9,12,17,20(26),21,24,27-dodecaene
CID 146246041

Frequently Asked Questions

What is the IUPAC name of 10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole?
The IUPAC name of 10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole (CID 122470341) is 10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole.
What is the SMILES notation for 10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole?
The canonical SMILES for 10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole is CC1(C)c2ccc(Br)cc2-c2cc3c4ccccc4n(-c4ccccc4)c3cc21.
What is the InChIKey of 10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole?
The InChIKey is YLUGBWSGGDKAHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H20BrN/c1-27(2)23-13-12-17(28)14-20(23)21-15-22-19-10-6-7-11-25(19)29(26(22)16-24(21)27)18-8-4-3-5-9-18/h3-16H,1-2H3.
What are the key properties of 10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole?
10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole has a molecular weight of 438.37 g/mol, XLogP of 7.85, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-bromo-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole is sourced from PubChem (CID 122470341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).