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1260178-67-3 | Pyrido[3,4-d]pyrimidine, 4-chloro-8-methoxy-
CAS No: 1260178-67-3 Catalog No: AG000QR5 MDL No:MFCD20258064
Product Description
Catalog Number:
AG000QR5
Chemical Name:
Pyrido[3,4-d]pyrimidine, 4-chloro-8-methoxy-
CAS Number:
1260178-67-3
Molecular Formula:
C8H6ClN3O
Molecular Weight:
195.6057
MDL Number:
MFCD20258064
IUPAC Name:
4-chloro-8-methoxypyrido[3,4-d]pyrimidine
InChI:
InChI=1S/C8H6ClN3O/c1-13-8-6-5(2-3-10-8)7(9)12-4-11-6/h2-4H,1H3
InChI Key:
OXNFDWDEWXFKLG-UHFFFAOYSA-N
SMILES:
COc1nccc2c1ncnc2Cl
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.02g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.606g/mol
Monoisotopic Mass:
195.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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