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88961-52-8 | Benzamide, 4-[3-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl]-
CAS No: 88961-52-8 Catalog No: AG0047JQ MDL No:
Product Description
Catalog Number:
AG0047JQ
Chemical Name:
Benzamide, 4-[3-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl]-
CAS Number:
88961-52-8
Molecular Formula:
C18H21ClN2O2
Molecular Weight:
332.8245
IUPAC Name:
4-[3-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl]benzamide
InChI:
InChI=1S/C18H21ClN2O2/c19-16-5-1-4-15(11-16)17(22)12-21-10-2-3-13-6-8-14(9-7-13)18(20)23/h1,4-9,11,17,21-22H,2-3,10,12H2,(H2,20,23)
InChI Key:
FEEMXNKAUQWODG-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)C(CNCCCc1ccc(cc1)C(=O)N)O
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.129g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
332.828g/mol
Monoisotopic Mass:
332.129g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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