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76352-10-8 | Benzamide,5-hydroxy-2-methoxy-N-[8-(phenylmethyl)-8-azabicyclo[3.2.1]oct-3-yl]-, exo-(9CI)
CAS No: 76352-10-8 Catalog No: AG0055KS MDL No:
Product Description
Catalog Number:
AG0055KS
Chemical Name:
Benzamide,5-hydroxy-2-methoxy-N-[8-(phenylmethyl)-8-azabicyclo[3.2.1]oct-3-yl]-, exo-(9CI)
CAS Number:
76352-10-8
Molecular Formula:
C22H26N2O3
Molecular Weight:
366.4534
IUPAC Name:
N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-5-hydroxy-2-methoxybenzamide
InChI:
InChI=1S/C22H26N2O3/c1-27-21-10-9-19(25)13-20(21)22(26)23-16-11-17-7-8-18(12-16)24(17)14-15-5-3-2-4-6-15/h2-6,9-10,13,16-18,25H,7-8,11-12,14H2,1H3,(H,23,26)
InChI Key:
NJCUKKMAUOPIPZ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(=O)NC1CC2CCC(C1)N2Cc1ccccc1)O
Properties
Complexity:
494
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.194g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
366.461g/mol
Monoisotopic Mass:
366.194g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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