Home Halogens N-(6-amino-1-butyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-2-chloro-N-ethylacetamide

N-(6-amino-1-butyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-2-chloro-N-ethylacetamide

CAS No.:
923131-57-1
Catalog Number:
AG019P8C
Molecular Formula:
C12H19ClN4O3
Molecular Weight:
302.7573
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Product Description
Catalog Number:
AG019P8C
Chemical Name:
N-(6-amino-1-butyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-2-chloro-N-ethylacetamide
CAS Number:
923131-57-1
Molecular Formula:
C12H19ClN4O3
Molecular Weight:
302.7573
MDL Number:
MFCD08444103
IUPAC Name:
N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-chloro-N-ethylacetamide
InChI:
InChI=1S/C12H19ClN4O3/c1-3-5-6-17-10(14)9(11(19)15-12(17)20)16(4-2)8(18)7-13/h3-7,14H2,1-2H3,(H,15,19,20)
InChI Key:
PALCSBHSDBHSOQ-UHFFFAOYSA-N
SMILES:
CCCCn1c(=O)[nH]c(=O)c(c1N)N(C(=O)CCl)CC
Properties
Complexity:
450  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.115g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
302.759g/mol
Monoisotopic Mass:
302.115g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
95.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties