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Home > Indoles and Oxindole > 503855-48-9
503855-48-9 | 1-(2-thienylmethyl)-1H-indole-2,3-dione
CAS No: 503855-48-9 Catalog No: AG00JJNB MDL No:MFCD06636432
Product Description
Catalog Number:
AG00JJNB
Chemical Name:
1-(2-thienylmethyl)-1H-indole-2,3-dione
CAS Number:
503855-48-9
Molecular Formula:
C13H9NO2S
Molecular Weight:
243.2811
MDL Number:
MFCD06636432
IUPAC Name:
1-(thiophen-2-ylmethyl)indole-2,3-dione
InChI:
InChI=1S/C13H9NO2S/c15-12-10-5-1-2-6-11(10)14(13(12)16)8-9-4-3-7-17-9/h1-7H,8H2
InChI Key:
QPHPMPRHESVMJK-UHFFFAOYSA-N
SMILES:
O=C1c2ccccc2N(C1=O)Cc1cccs1
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.035g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.28g/mol
Monoisotopic Mass:
243.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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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