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23672-07-3 | Benzamide, 5-(aminosulfonyl)-N-[[(2S)-1-ethyl-2-pyrrolidinyl]methyl]-2-methoxy-
CAS No: 23672-07-3 Catalog No: AG002O30 MDL No:MFCD00055220
Product Description
Catalog Number:
AG002O30
Chemical Name:
Benzamide, 5-(aminosulfonyl)-N-[[(2S)-1-ethyl-2-pyrrolidinyl]methyl]-2-methoxy-
CAS Number:
23672-07-3
Molecular Formula:
C15H23N3O4S
Molecular Weight:
341.4258
MDL Number:
MFCD00055220
IUPAC Name:
N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-methoxy-5-sulfamoylbenzamide
InChI:
InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)/t11-/m0/s1
InChI Key:
BGRJTUBHPOOWDU-NSHDSACASA-N
SMILES:
CCN1CCC[C@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N
UNII:
JTG7R315LK
Properties
Complexity:
505
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
341.141g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
341.426g/mol
Monoisotopic Mass:
341.141g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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