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77557-39-2 | Benzenesulfonamide, N-(2-hydroxy-3-(4-(phenylmethyl)-1-piperazinyl)pro pyl)-4-methyl-N-(2-(2-propentyloxy)phenyl)-
CAS No: 77557-39-2 Catalog No: AG00GBTJ MDL No:
Product Description
Catalog Number:
AG00GBTJ
Chemical Name:
Benzenesulfonamide, N-(2-hydroxy-3-(4-(phenylmethyl)-1-piperazinyl)pro pyl)-4-methyl-N-(2-(2-propentyloxy)phenyl)-
CAS Number:
77557-39-2
IUPAC Name:
N-[3-(4-benzylpiperazin-1-yl)-2-hydroxypropyl]-4-methyl-N-(2-prop-2-enoxyphenyl)benzenesulfonamide
InChI:
InChI=1S/C30H37N3O4S/c1-3-21-37-30-12-8-7-11-29(30)33(38(35,36)28-15-13-25(2)14-16-28)24-27(34)23-32-19-17-31(18-20-32)22-26-9-5-4-6-10-26/h3-16,27,34H,1,17-24H2,2H3
InChI Key:
MQURHQICQJJARX-UHFFFAOYSA-N
Properties
Complexity:
797
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
535.25g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
535.703g/mol
Monoisotopic Mass:
535.25g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
81.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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