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329217-07-4 | 7-Benzyloxy-10,11-dihydrodibenzo[b,f[[1,4]thiazepin-11-one
CAS No: 329217-07-4 Catalog No: AG00C922 MDL No:
Product Description
Catalog Number:
AG00C922
Chemical Name:
7-Benzyloxy-10,11-dihydrodibenzo[b,f[[1,4]thiazepin-11-one
CAS Number:
329217-07-4
IUPAC Name:
2-phenylmethoxy-5H-benzo[b][1,4]benzothiazepin-6-one
InChI:
InChI=1S/C20H15NO2S/c22-20-16-8-4-5-9-18(16)24-19-12-15(10-11-17(19)21-20)23-13-14-6-2-1-3-7-14/h1-12H,13H2,(H,21,22)
InChI Key:
ILEHOLFZCSNFEM-UHFFFAOYSA-N
Properties
Complexity:
437
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.082g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
333.405g/mol
Monoisotopic Mass:
333.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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