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Home Carbonyls {4-[(2,6-Dimethylmorpholin-4-yl)carbonyl]phenyl}amine

{4-[(2,6-Dimethylmorpholin-4-yl)carbonyl]phenyl}amine

CAS No.:
247225-27-0
Catalog Number:
AG00I4QL
Molecular Formula:
C13H18N2O2
Molecular Weight:
234.2942
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Product Description
Catalog Number:
AG00I4QL
Chemical Name:
{4-[(2,6-Dimethylmorpholin-4-yl)carbonyl]phenyl}amine
CAS Number:
247225-27-0
Molecular Formula:
C13H18N2O2
Molecular Weight:
234.2942
MDL Number:
MFCD01055422
IUPAC Name:
(4-aminophenyl)-(2,6-dimethylmorpholin-4-yl)methanone
InChI:
InChI=1S/C13H18N2O2/c1-9-7-15(8-10(2)17-9)13(16)11-3-5-12(14)6-4-11/h3-6,9-10H,7-8,14H2,1-2H3
InChI Key:
IKSBDRQBCCVQBT-UHFFFAOYSA-N
SMILES:
CC1OC(C)CN(C1)C(=O)c1ccc(cc1)N
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.137g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
234.299g/mol
Monoisotopic Mass:
234.137g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties