7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole

C25H17NS — CID 169028017

IUPAC7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole
SMILESCn1c2cc3sc4ccccc4c3cc2c2c(-c3ccccc3)cccc21
InChIInChI=1S/C25H17NS/c1-26-21-12-7-11-17(16-8-3-2-4-9-16)25(21)20-14-19-18-10-5-6-13-23(18)27-24(19)15-22(20)26/h2-15H,1H3
InChIKeyKWHGBZSHFQARRU-UHFFFAOYSA-N
MW363.49 g/mol
LogP7.37
Rot. Bonds1

About 7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole

7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole (PubChem CID 169028017) has the molecular formula C25H17NS and a molecular weight of 363.49 g/mol. Its IUPAC name is 7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole.

Molecular Properties

Compound Name7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole
PubChem CID169028017
Molecular FormulaC25H17NS
Molecular Weight363.49 g/mol
Exact Mass363.11
IUPAC Name7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole
SMILESCn1c2cc3sc4ccccc4c3cc2c2c(-c3ccccc3)cccc21
InChIInChI=1S/C25H17NS/c1-26-21-12-7-11-17(16-8-3-2-4-9-16)25(21)20-14-19-18-10-5-6-13-23(18)27-24(19)15-22(20)26/h2-15H,1H3
InChIKeyKWHGBZSHFQARRU-UHFFFAOYSA-N
XLogP7.37
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.49
LogP ≤ 57.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 7-methyl-11-phenyl-[1]benzothiolo[2,3-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

11-methyl-7-phenyl-[1]benzothiolo[3,2-b]carbazole
CID 169027727
7-methyl-9-phenyl-[1]benzothiolo[2,3-b]carbazole
CID 169027876
9-dibenzothiophen-2-yl-3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-5-phenylcarbazole
CID 170072891
5-methyl-1,11-diphenylindolo[3,2-b]carbazole
CID 176615313
11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole
CID 169027784
9-dibenzothiophen-2-yl-5-phenyl-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 170072885
9-dibenzothiophen-3-yl-5-phenyl-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 170072881
9-[4-(4-dibenzothiophen-2-ylphenyl)phenyl]-4-phenylcarbazole
CID 163988724
1-phenyldibenzothiophene;hydrobromide
CID 174679709
11-methyl-3-phenyl-[1]benzothiolo[3,2-b]carbazole
CID 169027644
N-dibenzothiophen-2-yl-N-[4-(9-methylcarbazol-4-yl)phenyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-3-amine
CID 145354821
7-[3-[3-([1]benzothiolo[2,3-b]carbazol-7-yl)phenyl]phenyl]-[1]benzothiolo[2,3-b]carbazole
CID 167193311

Frequently Asked Questions

What is the IUPAC name of 7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole?
The IUPAC name of 7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole (CID 169028017) is 7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole.
What is the SMILES notation for 7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole?
The canonical SMILES for 7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole is Cn1c2cc3sc4ccccc4c3cc2c2c(-c3ccccc3)cccc21.
What is the InChIKey of 7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole?
The InChIKey is KWHGBZSHFQARRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17NS/c1-26-21-12-7-11-17(16-8-3-2-4-9-16)25(21)20-14-19-18-10-5-6-13-23(18)27-24(19)15-22(20)26/h2-15H,1H3.
What are the key properties of 7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole?
7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole has a molecular weight of 363.49 g/mol, XLogP of 7.37, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-11-phenyl-[1]benzothiolo[2,3-b]carbazole is sourced from PubChem (CID 169028017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).