200,000+ products from a single source!
sales@angenechem.com
880791-53-7 | 5-(4-Chlorobenzylsulfonyl)-1,3,4-thiadiazol-2-amine
CAS No: 880791-53-7 Catalog No: AG004HP8 MDL No:MFCD06649066
Product Description
Catalog Number:
AG004HP8
Chemical Name:
5-(4-Chlorobenzylsulfonyl)-1,3,4-thiadiazol-2-amine
CAS Number:
880791-53-7
Molecular Formula:
C9H8ClN3O2S2
Molecular Weight:
289.7617
MDL Number:
MFCD06649066
IUPAC Name:
5-[(4-chlorophenyl)methylsulfonyl]-1,3,4-thiadiazol-2-amine
InChI:
InChI=1S/C9H8ClN3O2S2/c10-7-3-1-6(2-4-7)5-17(14,15)9-13-12-8(11)16-9/h1-4H,5H2,(H2,11,12)
InChI Key:
IMTLUOWYMZDTFC-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)CS(=O)(=O)c1nnc(s1)N
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.975g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.752g/mol
Monoisotopic Mass:
288.975g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.