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1196153-06-6 | Pyrido[3,4-d]pyrimidine, 2-chloro-5,6,7,8-tetrahydro-
CAS No: 1196153-06-6 Catalog No: AG000PBA MDL No:MFCD13189540
Product Description
Catalog Number:
AG000PBA
Chemical Name:
Pyrido[3,4-d]pyrimidine, 2-chloro-5,6,7,8-tetrahydro-
CAS Number:
1196153-06-6
Molecular Formula:
C7H8ClN3
Molecular Weight:
169.6115
MDL Number:
MFCD13189540
IUPAC Name:
2-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
InChI:
InChI=1S/C7H8ClN3/c8-7-10-3-5-1-2-9-4-6(5)11-7/h3,9H,1-2,4H2
InChI Key:
YMJIKGJKYMEOCM-UHFFFAOYSA-N
SMILES:
Clc1nc2CNCCc2cn1
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.041g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.612g/mol
Monoisotopic Mass:
169.041g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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