5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole

C26H19NS — CID 118689653

IUPAC5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole
SMILESCCc1ccc(-n2c3ccccc3c3c4sc5ccccc5c4ccc32)cc1
InChIInChI=1S/C26H19NS/c1-2-17-11-13-18(14-12-17)27-22-9-5-3-8-21(22)25-23(27)16-15-20-19-7-4-6-10-24(19)28-26(20)25/h3-16H,2H2,1H3
InChIKeyGGBGDAWJXKJAHZ-UHFFFAOYSA-N
MW377.51 g/mol
LogP7.71
Rot. Bonds2

About 5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole

5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole (PubChem CID 118689653) has the molecular formula C26H19NS and a molecular weight of 377.51 g/mol. Its IUPAC name is 5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole.

Molecular Properties

Compound Name5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole
PubChem CID118689653
Molecular FormulaC26H19NS
Molecular Weight377.51 g/mol
Exact Mass377.12
IUPAC Name5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole
SMILESCCc1ccc(-n2c3ccccc3c3c4sc5ccccc5c4ccc32)cc1
InChIInChI=1S/C26H19NS/c1-2-17-11-13-18(14-12-17)27-22-9-5-3-8-21(22)25-23(27)16-15-20-19-7-4-6-10-24(19)28-26(20)25/h3-16H,2H2,1H3
InChIKeyGGBGDAWJXKJAHZ-UHFFFAOYSA-N
XLogP7.71
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.51
LogP ≤ 57.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]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

5-(9-phenylcarbazol-2-yl)-[1]benzothiolo[3,2-c]carbazole
CID 170393989
[4-([1]benzothiolo[3,2-c]carbazol-5-yl)phenyl]boronic acid
CID 71235174
9-(4-ethylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 118689637
6,24-bis(4-carbazol-9-ylphenyl)-15-thia-6,24-diazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaene
CID 138736430
5-[4-[4-(3-tert-butylcarbazol-9-yl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole
CID 167193144
5-(3-methylphenyl)-[1]benzothiolo[3,2-c]carbazole
CID 121339080
N,5-diphenyl-N-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-c]carbazol-2-amine
CID 89448189
6-phenyl-24-(9-phenylcarbazol-3-yl)-15-thia-6,24-diazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaene
CID 118391181
2-[4-([1]benzothiolo[3,2-c]carbazol-5-yl)phenyl]benzene-1,3-dicarbonitrile
CID 122435836
N-[4-([1]benzothiolo[3,2-c]carbazol-5-yl)phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
CID 66585302
5-[3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4,6-bis(2-ethylphenyl)-2-methylphenyl]-[1]benzothiolo[3,2-c]carbazole
CID 139553252
5-(1,3-benzothiazol-6-yl)-[1]benzothiolo[3,2-c]carbazole
CID 118503078

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole?
The IUPAC name of 5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole (CID 118689653) is 5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole.
What is the SMILES notation for 5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole?
The canonical SMILES for 5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole is CCc1ccc(-n2c3ccccc3c3c4sc5ccccc5c4ccc32)cc1.
What is the InChIKey of 5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole?
The InChIKey is GGBGDAWJXKJAHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19NS/c1-2-17-11-13-18(14-12-17)27-22-9-5-3-8-21(22)25-23(27)16-15-20-19-7-4-6-10-24(19)28-26(20)25/h3-16H,2H2,1H3.
What are the key properties of 5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole?
5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole has a molecular weight of 377.51 g/mol, XLogP of 7.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethylphenyl)-[1]benzothiolo[3,2-c]carbazole is sourced from PubChem (CID 118689653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).