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148679-46-3 | Acetamide, N-[(3,4-dimethoxyphenyl)methyl]-N-[2-(phenylsulfinyl)ethyl]-
CAS No: 148679-46-3 Catalog No: AG001L3X MDL No:
Product Description
Catalog Number:
AG001L3X
Chemical Name:
Acetamide, N-[(3,4-dimethoxyphenyl)methyl]-N-[2-(phenylsulfinyl)ethyl]-
CAS Number:
148679-46-3
Molecular Formula:
C19H23NO4S
Molecular Weight:
361.4552
IUPAC Name:
N-[2-(benzenesulfinyl)ethyl]-N-[(3,4-dimethoxyphenyl)methyl]acetamide
InChI:
InChI=1S/C19H23NO4S/c1-15(21)20(11-12-25(22)17-7-5-4-6-8-17)14-16-9-10-18(23-2)19(13-16)24-3/h4-10,13H,11-12,14H2,1-3H3
InChI Key:
DNFDLWPGWWUOQY-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)CN(C(=O)C)CCS(=O)c1ccccc1
Properties
Complexity:
439
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.135g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
361.456g/mol
Monoisotopic Mass:
361.135g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
75A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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