Home Other Building Blocks 1-(2,3,4-trimethoxybenzoyl)piperazine

1-(2,3,4-trimethoxybenzoyl)piperazine

CAS No.:
93896-51-6
Catalog Number:
AG019TOD
Molecular Formula:
C14H20N2O4
Molecular Weight:
280.3196
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Product Description
Catalog Number:
AG019TOD
Chemical Name:
1-(2,3,4-trimethoxybenzoyl)piperazine
CAS Number:
93896-51-6
Molecular Formula:
C14H20N2O4
Molecular Weight:
280.3196
MDL Number:
MFCD11952928
IUPAC Name:
piperazin-1-yl-(2,3,4-trimethoxyphenyl)methanone
InChI:
InChI=1S/C14H20N2O4/c1-18-11-5-4-10(12(19-2)13(11)20-3)14(17)16-8-6-15-7-9-16/h4-5,15H,6-9H2,1-3H3
InChI Key:
RSGDCVBOCSMOCN-UHFFFAOYSA-N
SMILES:
COc1c(ccc(c1OC)OC)C(=O)N1CCNCC1
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.142g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
280.324g/mol
Monoisotopic Mass:
280.142g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
60A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties