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42182-64-9 | Acetamide, N-(2-benzothiazolylmethyl)- (9CI)
CAS No: 42182-64-9 Catalog No: AG00CNOS MDL No:MFCD12306342
Product Description
Catalog Number:
AG00CNOS
Chemical Name:
Acetamide, N-(2-benzothiazolylmethyl)- (9CI)
CAS Number:
42182-64-9
Molecular Formula:
C10H10N2OS
Molecular Weight:
206.2642
MDL Number:
MFCD12306342
IUPAC Name:
N-(1,3-benzothiazol-2-ylmethyl)acetamide
InChI:
InChI=1S/C10H10N2OS/c1-7(13)11-6-10-12-8-4-2-3-5-9(8)14-10/h2-5H,6H2,1H3,(H,11,13)
InChI Key:
RQSUAVZMWULJIX-UHFFFAOYSA-N
SMILES:
CC(=O)NCc1nc2c(s1)cccc2
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.051g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.263g/mol
Monoisotopic Mass:
206.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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