Home Other Building Blocks 2-[4-(2H-1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine

2-[4-(2H-1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine

CAS No.:
3605-01-4
Catalog Number:
AG0039YE
Molecular Formula:
C16H18N4O2
Molecular Weight:
298.3397
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
98%
In Stock USA
United States
$57
- +
10g
98%
In Stock USA
United States
$94
- +
25g
98%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG0039YE
Chemical Name:
2-[4-(2H-1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine
CAS Number:
3605-01-4
Molecular Formula:
C16H18N4O2
Molecular Weight:
298.3397
MDL Number:
MFCD00868264
IUPAC Name:
2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine
InChI:
InChI=1S/C16H18N4O2/c1-4-17-16(18-5-1)20-8-6-19(7-9-20)11-13-2-3-14-15(10-13)22-12-21-14/h1-5,10H,6-9,11-12H2
InChI Key:
OQDPVLVUJFGPGQ-UHFFFAOYSA-N
SMILES:
c1cnc(nc1)N1CCN(CC1)Cc1ccc2c(c1)OCO2
EC Number:
222-764-6
UNII:
DO22K1PRDJ
Properties
Complexity:
356  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.143g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.346g/mol
Monoisotopic Mass:
298.143g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
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Properties