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897359-93-2 | Pyrido[3,2-d]pyrimidine-2,4-diamine, 6-(3,4-dimethoxyphenyl)-
CAS No: 897359-93-2 Catalog No: AG0041B6 MDL No:
Product Description
Catalog Number:
AG0041B6
Chemical Name:
Pyrido[3,2-d]pyrimidine-2,4-diamine, 6-(3,4-dimethoxyphenyl)-
CAS Number:
897359-93-2
Molecular Formula:
C15H15N5O2
Molecular Weight:
297.3119
IUPAC Name:
6-(3,4-dimethoxyphenyl)pyrido[3,2-d]pyrimidine-2,4-diamine
InChI:
InChI=1S/C15H15N5O2/c1-21-11-6-3-8(7-12(11)22-2)9-4-5-10-13(18-9)14(16)20-15(17)19-10/h3-7H,1-2H3,(H4,16,17,19,20)
InChI Key:
RREOHLDDCYGABU-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)c1ccc2c(n1)c(N)nc(n2)N
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.123g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
297.318g/mol
Monoisotopic Mass:
297.123g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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