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58038-50-9

58038-50-9 | Acetamide, N-(2-benzothiazolylmethyl)-N-methyl- (9CI)

CAS No: 58038-50-9 Catalog No: AG00EMD7 MDL No:MFCD18823453

Product Description

Catalog Number:
AG00EMD7
Chemical Name:
Acetamide, N-(2-benzothiazolylmethyl)-N-methyl- (9CI)
CAS Number:
58038-50-9
Molecular Formula:
C11H12N2OS
Molecular Weight:
220.2908
MDL Number:
MFCD18823453
IUPAC Name:
N-(1,3-benzothiazol-2-ylmethyl)-N-methylacetamide
InChI:
InChI=1S/C11H12N2OS/c1-8(14)13(2)7-11-12-9-5-3-4-6-10(9)15-11/h3-6H,7H2,1-2H3
InChI Key:
URACTGLOQGWJGN-UHFFFAOYSA-N
SMILES:
CC(=O)N(Cc1nc2c(s1)cccc2)C

Properties

Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.067g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.29g/mol
Monoisotopic Mass:
220.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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