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24733-08-2 | 2H-Pyrido[3,2-b]-1,4-oxazine, 3,4-dihydro-2-phenyl-
CAS No: 24733-08-2 Catalog No: AG002PA5 MDL No:
Product Description
Catalog Number:
AG002PA5
Chemical Name:
2H-Pyrido[3,2-b]-1,4-oxazine, 3,4-dihydro-2-phenyl-
CAS Number:
24733-08-2
Molecular Formula:
C13H12N2O
Molecular Weight:
212.2472
IUPAC Name:
2-phenyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
InChI:
InChI=1S/C13H12N2O/c1-2-5-10(6-3-1)12-9-15-13-11(16-12)7-4-8-14-13/h1-8,12H,9H2,(H,14,15)
InChI Key:
BZLBFMNNOIOWQQ-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1CNc2c(O1)cccn2
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.252g/mol
Monoisotopic Mass:
212.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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