Home Aminos 5-(((1-(4-Methoxybenzyl)-1H-pyrazol-5-yl)amino)methylene)-2,2-dimethyl-1,3-dioxane-4,6-dione

5-(((1-(4-Methoxybenzyl)-1H-pyrazol-5-yl)amino)methylene)-2,2-dimethyl-1,3-dioxane-4,6-dione

CAS No.:
949556-46-1
Catalog Number:
AG019ER0
Molecular Formula:
C18H19N3O5
Molecular Weight:
357.3606
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$133
- +
250mg
95%
In Stock USA
United States
$221
- +
1g
95%
In Stock USA
United States
$441
- +
5g
95%
In Stock USA
United States
$1323
- +
Product Description
Catalog Number:
AG019ER0
Chemical Name:
5-(((1-(4-Methoxybenzyl)-1H-pyrazol-5-yl)amino)methylene)-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS Number:
949556-46-1
Molecular Formula:
C18H19N3O5
Molecular Weight:
357.3606
MDL Number:
MFCD27976547
IUPAC Name:
5-[[[2-[(4-methoxyphenyl)methyl]pyrazol-3-yl]amino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
InChI:
InChI=1S/C18H19N3O5/c1-18(2)25-16(22)14(17(23)26-18)10-19-15-8-9-20-21(15)11-12-4-6-13(24-3)7-5-12/h4-10,19H,11H2,1-3H3
InChI Key:
LBTSTNKBKYTZFF-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)Cn1nccc1NC=C1C(=O)OC(OC1=O)(C)C
Properties
Complexity:
547  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.132g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
357.366g/mol
Monoisotopic Mass:
357.132g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
91.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties