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Home > Imidazoles > 187235-38-7
187235-38-7 | (s)-2-nitro-6-(4-phenoxy-benzyloxy)-6,7-dihydro-5h-imidazo(2,1-b)(1,3)oxazine
CAS No: 187235-38-7 Catalog No: AG0074WI MDL No:
Product Description
Catalog Number:
AG0074WI
Chemical Name:
(s)-2-nitro-6-(4-phenoxy-benzyloxy)-6,7-dihydro-5h-imidazo(2,1-b)(1,3)oxazine
CAS Number:
187235-38-7
Molecular Formula:
C19H17N3O5
Molecular Weight:
367.3554
IUPAC Name:
(6S)-2-nitro-6-[(4-phenoxyphenyl)methoxy]-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine
InChI:
InChI=1S/C19H17N3O5/c23-22(24)18-11-21-10-17(13-26-19(21)20-18)25-12-14-6-8-16(9-7-14)27-15-4-2-1-3-5-15/h1-9,11,17H,10,12-13H2/t17-/m0/s1
InChI Key:
IZTYJZIECAMJBF-KRWDZBQOSA-N
SMILES:
[O-][N+](=O)c1cn2c(n1)OC[C@H](C2)OCc1ccc(cc1)Oc1ccccc1
Properties
Complexity:
488
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
367.117g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
367.361g/mol
Monoisotopic Mass:
367.117g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
91.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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