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24958-44-9 | Benzamide, 2-bromo-5-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]-4-methoxy-N-methyl-
CAS No: 24958-44-9 Catalog No: AG002PZD MDL No:
Product Description
Catalog Number:
AG002PZD
Chemical Name:
Benzamide, 2-bromo-5-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]-4-methoxy-N-methyl-
CAS Number:
24958-44-9
Molecular Formula:
C17H18BrNO4
Molecular Weight:
380.2331
IUPAC Name:
2-bromo-5-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]-4-methoxy-N-methylbenzamide
InChI:
InChI=1S/C17H18BrNO4/c1-19(8-7-11-3-5-12(20)6-4-11)17(22)13-9-15(21)16(23-2)10-14(13)18/h3-6,9-10,20-21H,7-8H2,1-2H3
InChI Key:
CRZBVPSGSPBXEZ-UHFFFAOYSA-N
SMILES:
COc1cc(Br)c(cc1O)C(=O)N(CCc1ccc(cc1)O)C
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.042g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
380.238g/mol
Monoisotopic Mass:
379.042g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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