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Home Aminos 2,4(1H,3H)-Pyrimidinedione,6-[[3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]amino]-1,3-dimethyl-,hydrochloride (1:1)

2,4(1H,3H)-Pyrimidinedione,6-[[3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]amino]-1,3-dimethyl-,hydrochloride (1:1)

CAS No.:
64887-14-5
Catalog Number:
AG006SA1
Molecular Formula:
C20H30ClN5O3
Molecular Weight:
423.9369
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$189
- +
10mg
99%
1 week
United States
$279
- +
25mg
99%
1 week
United States
$501
- +
Product Description
Catalog Number:
AG006SA1
Chemical Name:
2,4(1H,3H)-Pyrimidinedione,6-[[3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]amino]-1,3-dimethyl-,hydrochloride (1:1)
CAS Number:
64887-14-5
Molecular Formula:
C20H30ClN5O3
Molecular Weight:
423.9369
MDL Number:
MFCD00078601
IUPAC Name:
6-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]-1,3-dimethylpyrimidine-2,4-dione;hydrochloride
InChI:
InChI=1S/C20H29N5O3.ClH/c1-22-18(15-19(26)23(2)20(22)27)21-9-6-10-24-11-13-25(14-12-24)16-7-4-5-8-17(16)28-3;/h4-5,7-8,15,21H,6,9-14H2,1-3H3;1H
InChI Key:
KTMLZVUAXJERAT-UHFFFAOYSA-N
SMILES:
COc1ccccc1N1CCN(CC1)CCCNc1cc(=O)n(c(=O)n1C)C.Cl
UNII:
PVU92PZO12
NSC Number:
758226
Properties
Complexity:
588  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
423.204g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
423.942g/mol
Monoisotopic Mass:
423.204g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
68.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Genetic mapping of targets mediating differential chemical phenotypes in Plasmodium falciparum. Nature chemical biology 20091001
Properties