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824429-55-2 | 1-(6-Iodo-3,4-dihydro-1,8-naphthyridin-1(2H)-yl)-2,2-dimethylpropan-1-one
CAS No: 824429-55-2 Catalog No: AG004VZZ MDL No:MFCD06659022
Product Description
Catalog Number:
AG004VZZ
Chemical Name:
1-(6-Iodo-3,4-dihydro-1,8-naphthyridin-1(2H)-yl)-2,2-dimethylpropan-1-one
CAS Number:
824429-55-2
Molecular Formula:
C13H17IN2O
Molecular Weight:
344.1913
MDL Number:
MFCD06659022
IUPAC Name:
1-(6-iodo-3,4-dihydro-2H-1,8-naphthyridin-1-yl)-2,2-dimethylpropan-1-one
InChI:
InChI=1S/C13H17IN2O/c1-13(2,3)12(17)16-6-4-5-9-7-10(14)8-15-11(9)16/h7-8H,4-6H2,1-3H3
InChI Key:
BJYMBIKIEYRROY-UHFFFAOYSA-N
SMILES:
Ic1cnc2c(c1)CCCN2C(=O)C(C)(C)C
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.039g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
344.196g/mol
Monoisotopic Mass:
344.039g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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