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708987-59-1 | N-(1H-indol-5-yl)-2-thiophenecarboxamide
CAS No: 708987-59-1 Catalog No: AG01CAQF MDL No:MFCD03055808
Product Description
Catalog Number:
AG01CAQF
Chemical Name:
N-(1H-indol-5-yl)-2-thiophenecarboxamide
CAS Number:
708987-59-1
Molecular Formula:
C13H10N2OS
Molecular Weight:
242.2963
MDL Number:
MFCD03055808
IUPAC Name:
N-(1H-indol-5-yl)thiophene-2-carboxamide
InChI:
InChI=1S/C13H10N2OS/c16-13(12-2-1-7-17-12)15-10-3-4-11-9(8-10)5-6-14-11/h1-8,14H,(H,15,16)
InChI Key:
NATNBAQTCHTIFV-UHFFFAOYSA-N
SMILES:
O=C(c1cccs1)Nc1ccc2c(c1)cc[nH]2
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.051g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
242.296g/mol
Monoisotopic Mass:
242.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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