Home Carboxys tert-Butyl 2-(methylthio)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5h)-carboxylate

tert-Butyl 2-(methylthio)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5h)-carboxylate

CAS No.:
259809-78-4
Catalog Number:
AG00BI16
Molecular Formula:
C13H19N3O2S
Molecular Weight:
281.3739
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$800
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Product Description
Catalog Number:
AG00BI16
Chemical Name:
tert-Butyl 2-(methylthio)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5h)-carboxylate
CAS Number:
259809-78-4
Molecular Formula:
C13H19N3O2S
Molecular Weight:
281.3739
MDL Number:
MFCD21604165
IUPAC Name:
tert-butyl 2-methylsulfanyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate
InChI:
InChI=1S/C13H19N3O2S/c1-13(2,3)18-12(17)16-6-5-10-9(8-16)7-14-11(15-10)19-4/h7H,5-6,8H2,1-4H3
InChI Key:
DFPYVWSMGRQYCN-UHFFFAOYSA-N
SMILES:
CSc1ncc2c(n1)CCN(C2)C(=O)OC(C)(C)C
Properties
Complexity:
332  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.12g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.374g/mol
Monoisotopic Mass:
281.12g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties