5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole

C16H14N2O3S2 — CID 53112003

IUPAC5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole
SMILESCC1Cc2ccccc2N1S(=O)(=O)c1ccc(-c2ccno2)s1
InChIInChI=1S/C16H14N2O3S2/c1-11-10-12-4-2-3-5-13(12)18(11)23(19,20)16-7-6-15(22-16)14-8-9-17-21-14/h2-9,11H,10H2,1H3
InChIKeyRZIIOLVTAOGGJQ-UHFFFAOYSA-N
MW346.43 g/mol
LogP3.54
Rot. Bonds3

About 5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole

5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole (PubChem CID 53112003) has the molecular formula C16H14N2O3S2 and a molecular weight of 346.43 g/mol. Its IUPAC name is 5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole.

Molecular Properties

Compound Name5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole
PubChem CID53112003
Molecular FormulaC16H14N2O3S2
Molecular Weight346.43 g/mol
Exact Mass346.04
IUPAC Name5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole
SMILESCC1Cc2ccccc2N1S(=O)(=O)c1ccc(-c2ccno2)s1
InChIInChI=1S/C16H14N2O3S2/c1-11-10-12-4-2-3-5-13(12)18(11)23(19,20)16-7-6-15(22-16)14-8-9-17-21-14/h2-9,11H,10H2,1H3
InChIKeyRZIIOLVTAOGGJQ-UHFFFAOYSA-N
XLogP3.54
TPSA63.41 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole 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

3-[5-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]thiophen-2-yl]-5-(trifluoromethyl)-1,2-oxazole
CID 92707358
2-methyl-1-thiophen-2-ylsulfonyl-2,3-dihydroindole
CID 2943362
5-[5-(2,3-dihydro-1,4-benzothiazin-4-ylsulfonyl)thiophen-2-yl]-1,2-oxazole
CID 39730338
2-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1-piperidin-1-ylethanone
CID 53067992
5-[5-(3-pyridin-4-ylazetidin-1-yl)sulfonylthiophen-2-yl]-1,2-oxazole
CID 56891247
2-methyl-1-(1-methylimidazol-4-yl)sulfonyl-2,3-dihydroindole
CID 20958624
4-methyl-5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-1,3-thiazol-2-amine
CID 63945978
1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole
CID 42994759
(2S,6R)-2-cyclopropyl-4-[5-(1,2-oxazol-5-yl)thiophen-2-yl]sulfonyl-6-phenylmorpholine
CID 155916573
1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole
CID 3750553
1-methyl-5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]imidazol-4-amine
CID 63977911
3-(3-fluorophenyl)-5-[5-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]thiophen-3-yl]-1,2,4-oxadiazole
CID 95092100

Frequently Asked Questions

What is the IUPAC name of 5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole?
The IUPAC name of 5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole (CID 53112003) is 5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole.
What is the SMILES notation for 5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole?
The canonical SMILES for 5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole is CC1Cc2ccccc2N1S(=O)(=O)c1ccc(-c2ccno2)s1.
What is the InChIKey of 5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole?
The InChIKey is RZIIOLVTAOGGJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3S2/c1-11-10-12-4-2-3-5-13(12)18(11)23(19,20)16-7-6-15(22-16)14-8-9-17-21-14/h2-9,11H,10H2,1H3.
What are the key properties of 5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole?
5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole has a molecular weight of 346.43 g/mol, XLogP of 3.54, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]-1,2-oxazole is sourced from PubChem (CID 53112003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).