2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene

C14H12O2S2 — CID 138975244

IUPAC2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene
SMILESO=S(=O)(C1=Cc2ccccc2CC1)c1cccs1
InChIInChI=1S/C14H12O2S2/c15-18(16,14-6-3-9-17-14)13-8-7-11-4-1-2-5-12(11)10-13/h1-6,9-10H,7-8H2
InChIKeyUNTMQNQKIUYVDS-UHFFFAOYSA-N
MW276.38 g/mol
LogP3.51
Rot. Bonds2

About 2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene

2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene (PubChem CID 138975244) has the molecular formula C14H12O2S2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene.

Molecular Properties

Compound Name2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene
PubChem CID138975244
Molecular FormulaC14H12O2S2
Molecular Weight276.38 g/mol
Exact Mass276.03
IUPAC Name2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene
SMILESO=S(=O)(C1=Cc2ccccc2CC1)c1cccs1
InChIInChI=1S/C14H12O2S2/c15-18(16,14-6-3-9-17-14)13-8-7-11-4-1-2-5-12(11)10-13/h1-6,9-10H,7-8H2
InChIKeyUNTMQNQKIUYVDS-UHFFFAOYSA-N
XLogP3.51
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene 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-(3,4-dihydronaphthalen-2-ylsulfonyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 16604937
1-(3,4-dihydronaphthalen-2-ylsulfonyl)-4-methyl-1,4-diazepane
CID 75412961
(4-methylphenyl) 3,4-dihydronaphthalene-2-sulfonate
CID 18190618
methyl 3-(3,4-dihydronaphthalen-2-ylsulfonylamino)thiophene-2-carboxylate
CID 17465245
1-(4-bromophenyl)sulfonyl-4-(3,4-dihydronaphthalen-2-ylsulfonyl)piperazine
CID 39911934
N-cyclohexyl-3,4-dihydronaphthalene-2-sulfonamide
CID 18190615
2-thiophen-2-ylsulfonylsulfonylthiophene
CID 141485126
(4aR,8aR)-1-(3,4-dihydronaphthalen-2-ylsulfonyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline
CID 100878633
methyl 6-(3,4-dihydronaphthalen-2-ylsulfonylamino)hexanoate
CID 39912433
N'-(3,4-dihydronaphthalen-2-ylsulfonyl)benzohydrazide
CID 18190358
1-(3,4-dihydronaphthalen-2-ylsulfonyl)piperidine-4-carboxamide
CID 7590284
5-[(3,4-dihydronaphthalen-2-ylsulfonylamino)methyl]-N,N-dimethylthiophene-2-sulfonamide
CID 24581155

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene?
The IUPAC name of 2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene (CID 138975244) is 2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene.
What is the SMILES notation for 2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene?
The canonical SMILES for 2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene is O=S(=O)(C1=Cc2ccccc2CC1)c1cccs1.
What is the InChIKey of 2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene?
The InChIKey is UNTMQNQKIUYVDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O2S2/c15-18(16,14-6-3-9-17-14)13-8-7-11-4-1-2-5-12(11)10-13/h1-6,9-10H,7-8H2.
What are the key properties of 2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene?
2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene has a molecular weight of 276.38 g/mol, XLogP of 3.51, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dihydronaphthalen-2-ylsulfonyl)thiophene is sourced from PubChem (CID 138975244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).