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1203499-40-4 | 1-Benzyl-7-iodo-1H-pyrido[2,3-b][1,4]oxazin-2(3H)-one
CAS No: 1203499-40-4 Catalog No: AG009KVH MDL No:MFCD13176668
Product Description
Catalog Number:
AG009KVH
Chemical Name:
1-Benzyl-7-iodo-1H-pyrido[2,3-b][1,4]oxazin-2(3H)-one
CAS Number:
1203499-40-4
Molecular Formula:
C14H11IN2O2
Molecular Weight:
366.1538
MDL Number:
MFCD13176668
IUPAC Name:
1-benzyl-7-iodopyrido[2,3-b][1,4]oxazin-2-one
InChI:
InChI=1S/C14H11IN2O2/c15-11-6-12-14(16-7-11)19-9-13(18)17(12)8-10-4-2-1-3-5-10/h1-7H,8-9H2
InChI Key:
BKGCQXKQWKTXCS-UHFFFAOYSA-N
SMILES:
Ic1cnc2c(c1)N(Cc1ccccc1)C(=O)CO2
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.987g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
366.158g/mol
Monoisotopic Mass:
365.987g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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