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828920-99-6 | Methanesulfonamide, N-[4-chloro-5-(1-pyrrolidinyl)-2-thiazolyl]-
CAS No: 828920-99-6 Catalog No: AG004VVB MDL No:
Product Description
Catalog Number:
AG004VVB
Chemical Name:
Methanesulfonamide, N-[4-chloro-5-(1-pyrrolidinyl)-2-thiazolyl]-
CAS Number:
828920-99-6
Molecular Formula:
C8H12ClN3O2S2
Molecular Weight:
281.7828
IUPAC Name:
N-(4-chloro-5-pyrrolidin-1-yl-1,3-thiazol-2-yl)methanesulfonamide
InChI:
InChI=1S/C8H12ClN3O2S2/c1-16(13,14)11-8-10-6(9)7(15-8)12-4-2-3-5-12/h2-5H2,1H3,(H,10,11)
InChI Key:
WZKOUOBHMBKRAZ-UHFFFAOYSA-N
SMILES:
Clc1nc(sc1N1CCCC1)NS(=O)(=O)C
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.006g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.773g/mol
Monoisotopic Mass:
281.006g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
98.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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