Home Sulfos 3-amino-N-(2-aminoethyl)-N-[(2-phenoxyphenyl)methyl]propane-1-sulfonamide

3-amino-N-(2-aminoethyl)-N-[(2-phenoxyphenyl)methyl]propane-1-sulfonamide

CAS No.:
1797772-54-3
Catalog Number:
AG01ACMM
Molecular Formula:
C18H25N3O3S
Molecular Weight:
363.4744
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Product Description
Catalog Number:
AG01ACMM
Chemical Name:
3-amino-N-(2-aminoethyl)-N-[(2-phenoxyphenyl)methyl]propane-1-sulfonamide
CAS Number:
1797772-54-3
Molecular Formula:
C18H25N3O3S
Molecular Weight:
363.4744
MDL Number:
MFCD27959351
IUPAC Name:
3-amino-N-(2-aminoethyl)-N-[(2-phenoxyphenyl)methyl]propane-1-sulfonamide
InChI:
InChI=1S/C18H25N3O3S/c19-11-6-14-25(22,23)21(13-12-20)15-16-7-4-5-10-18(16)24-17-8-2-1-3-9-17/h1-5,7-10H,6,11-15,19-20H2
InChI Key:
YLUOGOUQUFJHTD-UHFFFAOYSA-N
SMILES:
NCCN(S(=O)(=O)CCCN)Cc1ccccc1Oc1ccccc1
Properties
Complexity:
461  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.162g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
363.476g/mol
Monoisotopic Mass:
363.162g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties