8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide

C17H14O2S — CID 157104762

IUPAC8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide
SMILESCc1ccc2c(c1)C1=C(C2)c2ccccc2S(=O)(=O)C1
InChIInChI=1S/C17H14O2S/c1-11-6-7-12-9-15-13-4-2-3-5-17(13)20(18,19)10-16(15)14(12)8-11/h2-8H,9-10H2,1H3
InChIKeyBWVCYLGKUBKJPY-UHFFFAOYSA-N
MW282.36 g/mol
LogP3.25
Rot. Bonds

About 8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide

8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide (PubChem CID 157104762) has the molecular formula C17H14O2S and a molecular weight of 282.36 g/mol. Its IUPAC name is 8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide.

Molecular Properties

Compound Name8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide
PubChem CID157104762
Molecular FormulaC17H14O2S
Molecular Weight282.36 g/mol
Exact Mass282.07
IUPAC Name8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide
SMILESCc1ccc2c(c1)C1=C(C2)c2ccccc2S(=O)(=O)C1
InChIInChI=1S/C17H14O2S/c1-11-6-7-12-9-15-13-4-2-3-5-17(13)20(18,19)10-16(15)14(12)8-11/h2-8H,9-10H2,1H3
InChIKeyBWVCYLGKUBKJPY-UHFFFAOYSA-N
XLogP3.25
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.36
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide 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

9-methyl-6,11-dihydrobenzo[c][1,5]benzothiazepine 5,5-dioxide
CID 122641676
3-methyl-9H-thioxanthene 10,10-dioxide
CID 126688682
1,1-dioxo-1-benzothiophen-3-one;ethane
CID 90843424
hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,22-undecaene
CID 58250867
(3Z)-3-ethylidene-1-benzothiophene 1,1-dioxide
CID 89332319
2-methyl-11,12-dihydroindeno[2,1-a]fluorene
CID 91412368
ethane;2-methyl-10,10-dioxothioxanthen-9-one
CID 145125707
8-methyl-5,5-dioxo-4H-[1]benzothiepino[4,3-b]furan-10-one
CID 20642525
3-(6-methylnaphthalen-2-yl)-9H-fluorene
CID 123870070
10-methyl-7,12-dihydroindeno[1,2-a]fluorene
CID 161385302
3-methyl-6,7,8,9,10,11-hexahydro-5H-cycloocta[a]indene
CID 53360534
8-methyl-5,11-dihydrobenzo[c][1]benzazepin-6-one
CID 102431030

Frequently Asked Questions

What is the IUPAC name of 8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide?
The IUPAC name of 8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide (CID 157104762) is 8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide.
What is the SMILES notation for 8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide?
The canonical SMILES for 8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide is Cc1ccc2c(c1)C1=C(C2)c2ccccc2S(=O)(=O)C1.
What is the InChIKey of 8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide?
The InChIKey is BWVCYLGKUBKJPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O2S/c1-11-6-7-12-9-15-13-4-2-3-5-17(13)20(18,19)10-16(15)14(12)8-11/h2-8H,9-10H2,1H3.
What are the key properties of 8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide?
8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide has a molecular weight of 282.36 g/mol, XLogP of 3.25, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-6,11-dihydroindeno[1,2-c]thiochromene 5,5-dioxide is sourced from PubChem (CID 157104762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).