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1538453-90-5 | 3-methoxy-N-(pyrrolidin-3-yl)benzenesulfonamide
CAS No: 1538453-90-5 Catalog No: AG01DHV2 MDL No:MFCD25093240
Product Description
Catalog Number:
AG01DHV2
Chemical Name:
3-methoxy-N-(pyrrolidin-3-yl)benzenesulfonamide
CAS Number:
1538453-90-5
Molecular Formula:
C11H16N2O3S
Molecular Weight:
256.3213
MDL Number:
MFCD25093240
IUPAC Name:
3-methoxy-N-pyrrolidin-3-ylbenzenesulfonamide
InChI:
InChI=1S/C11H16N2O3S/c1-16-10-3-2-4-11(7-10)17(14,15)13-9-5-6-12-8-9/h2-4,7,9,12-13H,5-6,8H2,1H3
InChI Key:
LVCHPLIGBNGDGC-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)S(=O)(=O)NC1CNCC1
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.088g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
256.32g/mol
Monoisotopic Mass:
256.088g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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