5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole

C27H22N2 — CID 162402287

IUPAC5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole
SMILESCc1ccc(-c2cc3c(c4ccccc4n3C)c3c2c2ccccc2n3C)cc1
InChIInChI=1S/C27H22N2/c1-17-12-14-18(15-13-17)21-16-24-26(20-9-5-6-10-22(20)28(24)2)27-25(21)19-8-4-7-11-23(19)29(27)3/h4-16H,1-3H3
InChIKeyBEVKYNIJQNRRTB-UHFFFAOYSA-N
MW374.49 g/mol
LogP6.95
Rot. Bonds1

About 5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole

5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole (PubChem CID 162402287) has the molecular formula C27H22N2 and a molecular weight of 374.49 g/mol. Its IUPAC name is 5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole.

Molecular Properties

Compound Name5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole
PubChem CID162402287
Molecular FormulaC27H22N2
Molecular Weight374.49 g/mol
Exact Mass374.18
IUPAC Name5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole
SMILESCc1ccc(-c2cc3c(c4ccccc4n3C)c3c2c2ccccc2n3C)cc1
InChIInChI=1S/C27H22N2/c1-17-12-14-18(15-13-17)21-16-24-26(20-9-5-6-10-22(20)28(24)2)27-25(21)19-8-4-7-11-23(19)29(27)3/h4-16H,1-3H3
InChIKeyBEVKYNIJQNRRTB-UHFFFAOYSA-N
XLogP6.95
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.49
LogP ≤ 56.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-(2-bromophenyl)-5,12-dimethylindolo[3,2-a]carbazole
CID 162402293
2-(2-methoxyethyl)-9-methyl-4-(4-methylphenyl)carbazole
CID 102587501
3,6-dimethyl-4-phenylpyrrolo[2,3-c]carbazole
CID 139052416
2,4,9-trimethylcarbazole
CID 12613661
5,6,11,12-tetramethylindolo[3,2-b]carbazole
CID 134194403
5,6,7,12-tetramethylindolo[3,2-c]carbazole
CID 134194406
16,20-dimethyl-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14(19),15,17,21,23-dodecaene
CID 164939565
11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole
CID 58410457
ethane;9-methyl-3-(9-methylcarbazol-3-yl)carbazole
CID 158738351
1-methyl-3-(4-methylphenyl)indole
CID 58931542
9-methylcarbazole;9-methyl-3,6-diphenylcarbazole;9-methyl-3-(2-methylphenyl)carbazole;9-methyl-3-(4-methylphenyl)carbazole;9-methyl-3-phenylcarbazole
CID 157294654
4-(9-methylcarbazol-1-yl)-N,N-bis[4-(9-methylcarbazol-1-yl)phenyl]aniline
CID 146558759

Frequently Asked Questions

What is the IUPAC name of 5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole?
The IUPAC name of 5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole (CID 162402287) is 5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole.
What is the SMILES notation for 5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole?
The canonical SMILES for 5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole is Cc1ccc(-c2cc3c(c4ccccc4n3C)c3c2c2ccccc2n3C)cc1.
What is the InChIKey of 5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole?
The InChIKey is BEVKYNIJQNRRTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22N2/c1-17-12-14-18(15-13-17)21-16-24-26(20-9-5-6-10-22(20)28(24)2)27-25(21)19-8-4-7-11-23(19)29(27)3/h4-16H,1-3H3.
What are the key properties of 5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole?
5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole has a molecular weight of 374.49 g/mol, XLogP of 6.95, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,12-dimethyl-7-(4-methylphenyl)indolo[3,2-a]carbazole is sourced from PubChem (CID 162402287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).