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Home > Pyridines > 251992-66-2
251992-66-2 | Thieno[2,3-c]pyridine-2-carboxamide, 4-[(4-methylphenyl)thio]-
CAS No: 251992-66-2 Catalog No: AG002QUU MDL No:MFCD09038566
Product Description
Catalog Number:
AG002QUU
Chemical Name:
Thieno[2,3-c]pyridine-2-carboxamide, 4-[(4-methylphenyl)thio]-
CAS Number:
251992-66-2
Molecular Formula:
C15H12N2OS2
Molecular Weight:
300.3986
MDL Number:
MFCD09038566
IUPAC Name:
4-(4-methylphenyl)sulfanylthieno[2,3-c]pyridine-2-carboxamide
InChI:
InChI=1S/C15H12N2OS2/c1-9-2-4-10(5-3-9)19-13-7-17-8-14-11(13)6-12(20-14)15(16)18/h2-8H,1H3,(H2,16,18)
InChI Key:
QQGWEXFLMJGCAL-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)Sc1cncc2c1cc(s2)C(=O)N
UNII:
TP7TB1SSZD
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.039g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
300.394g/mol
Monoisotopic Mass:
300.039g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Literature
| Title | Journal |
|---|---|
| Selective inhibition of ICAM-1 and E-selectin expression in human endothelial cells. 2. Aryl modifications of 4-(aryloxy)thieno[2,3-c]pyridines with fine-tuning at C-2 carbamides. | Journal of medicinal chemistry 20011011 |
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