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99615-64-2 | 2,3-DIHYDRO-N-METHYL-2-OXO-6-BENZO[D]THIAZOLECARBOXAMIDE
CAS No: 99615-64-2 Catalog No: AG005S9W MDL No:
Product Description
Catalog Number:
AG005S9W
Chemical Name:
2,3-DIHYDRO-N-METHYL-2-OXO-6-BENZO[D]THIAZOLECARBOXAMIDE
CAS Number:
99615-64-2
Molecular Formula:
C9H8N2O2S
Molecular Weight:
208.2370
IUPAC Name:
N-methyl-2-oxo-3H-1,3-benzothiazole-6-carboxamide
InChI:
InChI=1S/C9H8N2O2S/c1-10-8(12)5-2-3-6-7(4-5)14-9(13)11-6/h2-4H,1H3,(H,10,12)(H,11,13)
InChI Key:
IUMKDTFJKOASIJ-UHFFFAOYSA-N
SMILES:
CNC(=O)c1ccc2c(c1)sc(=O)[nH]2
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.031g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
208.235g/mol
Monoisotopic Mass:
208.031g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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