1-phenylthieno[2,3-d]pyrazole

C11H8N2S — CID 11229409

IUPAC1-phenylthieno[2,3-d]pyrazole
SMILESc1ccc(-n2ncc3sccc32)cc1
InChIInChI=1S/C11H8N2S/c1-2-4-9(5-3-1)13-10-6-7-14-11(10)8-12-13/h1-8H
InChIKeyOKLYDITWBJPURK-UHFFFAOYSA-N
MW200.27 g/mol
LogP3.09
Rot. Bonds1

About 1-phenylthieno[2,3-d]pyrazole

1-phenylthieno[2,3-d]pyrazole (PubChem CID 11229409) has the molecular formula C11H8N2S and a molecular weight of 200.27 g/mol. Its IUPAC name is 1-phenylthieno[2,3-d]pyrazole.

Molecular Properties

Compound Name1-phenylthieno[2,3-d]pyrazole
PubChem CID11229409
Molecular FormulaC11H8N2S
Molecular Weight200.27 g/mol
Exact Mass200.04
IUPAC Name1-phenylthieno[2,3-d]pyrazole
SMILESc1ccc(-n2ncc3sccc32)cc1
InChIInChI=1S/C11H8N2S/c1-2-4-9(5-3-1)13-10-6-7-14-11(10)8-12-13/h1-8H
InChIKeyOKLYDITWBJPURK-UHFFFAOYSA-N
XLogP3.09
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.27
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(trifluoromethyl)phenyl]thieno[2,3-d]pyrazole
CID 11818011
1-phenyl-[1]benzothiolo[2,3-d]pyrazole
CID 141025136
1-phenylindazol-5-amine
CID 83414114
N-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine
CID 90988497
1-phenyl-5-thiophen-2-yltriazole
CID 121010770
4-bromo-5-methyl-1-phenylindazole
CID 74888869
10-phenyl-5-thia-1,8,11,12-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaene
CID 12689849
4-chloro-1-phenylpyrazolo[3,4-c]pyridine-5-carboxylic acid
CID 122458585
1,5-diphenyltetrazole;2-methyl-1,3-thiazole
CID 175112675
5-bromo-6-methyl-1-phenylindazole
CID 11818523
(2-phenylpyrazol-3-yl)-thiophen-2-ylmethanol
CID 107329836
5-(3-chlorothiophen-2-yl)-1-phenylpyrazole
CID 1470875

Frequently Asked Questions

What is the IUPAC name of 1-phenylthieno[2,3-d]pyrazole?
The IUPAC name of 1-phenylthieno[2,3-d]pyrazole (CID 11229409) is 1-phenylthieno[2,3-d]pyrazole.
What is the SMILES notation for 1-phenylthieno[2,3-d]pyrazole?
The canonical SMILES for 1-phenylthieno[2,3-d]pyrazole is c1ccc(-n2ncc3sccc32)cc1.
What is the InChIKey of 1-phenylthieno[2,3-d]pyrazole?
The InChIKey is OKLYDITWBJPURK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2S/c1-2-4-9(5-3-1)13-10-6-7-14-11(10)8-12-13/h1-8H.
What are the key properties of 1-phenylthieno[2,3-d]pyrazole?
1-phenylthieno[2,3-d]pyrazole has a molecular weight of 200.27 g/mol, XLogP of 3.09, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenylthieno[2,3-d]pyrazole is sourced from PubChem (CID 11229409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).