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89242-45-5 | Thieno[2,3-c]pyridine-5-carboxylic acid, 7-phenyl-
CAS No: 89242-45-5 Catalog No: AG0042M2 MDL No:
Product Description
Catalog Number:
AG0042M2
Chemical Name:
Thieno[2,3-c]pyridine-5-carboxylic acid, 7-phenyl-
CAS Number:
89242-45-5
Molecular Formula:
C14H9NO2S
Molecular Weight:
255.2918
IUPAC Name:
7-phenylthieno[2,3-c]pyridine-5-carboxylic acid
InChI:
InChI=1S/C14H9NO2S/c16-14(17)11-8-10-6-7-18-13(10)12(15-11)9-4-2-1-3-5-9/h1-8H,(H,16,17)
InChI Key:
OPRVRPWASLNSMC-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2ccsc2c(n1)c1ccccc1
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.035g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.291g/mol
Monoisotopic Mass:
255.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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