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88819-54-9 | Acetamide, 2-(2-benzothiazolylthio)-N-(2-hydroxyethyl)-
CAS No: 88819-54-9 Catalog No: AG004AQE MDL No:
Product Description
Catalog Number:
AG004AQE
Chemical Name:
Acetamide, 2-(2-benzothiazolylthio)-N-(2-hydroxyethyl)-
CAS Number:
88819-54-9
Molecular Formula:
C11H12N2O2S2
Molecular Weight:
268.3552
IUPAC Name:
2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-hydroxyethyl)acetamide
InChI:
InChI=1S/C11H12N2O2S2/c14-6-5-12-10(15)7-16-11-13-8-3-1-2-4-9(8)17-11/h1-4,14H,5-7H2,(H,12,15)
InChI Key:
BYWOWCXZNUQHDC-UHFFFAOYSA-N
SMILES:
OCCNC(=O)CSc1nc2c(s1)cccc2
NSC Number:
601365
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.034g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
268.349g/mol
Monoisotopic Mass:
268.034g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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