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502936-30-3 | Oxazolidine, 4-(phenylmethyl)-3-[(phenylthio)methyl]-, (4S)-
CAS No: 502936-30-3 Catalog No: AG006V5O MDL No:
Product Description
Catalog Number:
AG006V5O
Chemical Name:
Oxazolidine, 4-(phenylmethyl)-3-[(phenylthio)methyl]-, (4S)-
CAS Number:
502936-30-3
Molecular Formula:
C17H19NOS
Molecular Weight:
285.4039
IUPAC Name:
(4S)-4-benzyl-3-(phenylsulfanylmethyl)-1,3-oxazolidine
InChI:
InChI=1S/C17H19NOS/c1-3-7-15(8-4-1)11-16-12-19-13-18(16)14-20-17-9-5-2-6-10-17/h1-10,16H,11-14H2/t16-/m0/s1
InChI Key:
JUTKAMMVKLFQFE-INIZCTEOSA-N
SMILES:
c1ccc(cc1)SCN1COC[C@@H]1Cc1ccccc1
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
285.119g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.405g/mol
Monoisotopic Mass:
285.119g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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