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Home > Pyridines > 1170023-46-7
1170023-46-7 | Pyrido[4,3-d]pyrimidine-2,4(1H,3H)-dione, 5,6,7,8-tetrahydro-, hydrochloride (1:1)
CAS No: 1170023-46-7 Catalog No: AG000DIU MDL No:
Product Description
Catalog Number:
AG000DIU
Chemical Name:
Pyrido[4,3-d]pyrimidine-2,4(1H,3H)-dione, 5,6,7,8-tetrahydro-, hydrochloride (1:1)
CAS Number:
1170023-46-7
Molecular Formula:
C7H10ClN3O2
Molecular Weight:
203.6262
IUPAC Name:
5,6,7,8-tetrahydro-1H-pyrido[4,3-d]pyrimidine-2,4-dione;hydrochloride
InChI:
InChI=1S/C7H9N3O2.ClH/c11-6-4-3-8-2-1-5(4)9-7(12)10-6;/h8H,1-3H2,(H2,9,10,11,12);1H
InChI Key:
KSZSWTZRQBKBCB-UHFFFAOYSA-N
SMILES:
O=c1[nH]c(=O)[nH]c2c1CNCC2.Cl
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.046g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
203.626g/mol
Monoisotopic Mass:
203.046g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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