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15777-41-0 | Acetamide, 2-chloro-N-[5-(1-methylethyl)-1,3,4-thiadiazol-2-yl]-
CAS No: 15777-41-0 Catalog No: AG001PON MDL No:MFCD00462850
Product Description
Catalog Number:
AG001PON
Chemical Name:
Acetamide, 2-chloro-N-[5-(1-methylethyl)-1,3,4-thiadiazol-2-yl]-
CAS Number:
15777-41-0
Molecular Formula:
C7H10ClN3OS
Molecular Weight:
219.6918
MDL Number:
MFCD00462850
IUPAC Name:
2-chloro-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)acetamide
InChI:
InChI=1S/C7H10ClN3OS/c1-4(2)6-10-11-7(13-6)9-5(12)3-8/h4H,3H2,1-2H3,(H,9,11,12)
InChI Key:
AARFUCMXVZRFBG-UHFFFAOYSA-N
SMILES:
ClCC(=O)Nc1nnc(s1)C(C)C
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.023g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.687g/mol
Monoisotopic Mass:
219.023g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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