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173154-01-3 | 2-Oxazolidinone, 3-[(2S,4S)-4-azido-2-(1-methylethyl)-1-oxo-4-[(2S,4S)-tetrahydro-4-(1-methylethyl)-5-oxo-2-furanyl]butyl]-4-(phenylmethyl)-, (4S)-
CAS No: 173154-01-3 Catalog No: AG001YNT MDL No:
Product Description
Catalog Number:
AG001YNT
Chemical Name:
2-Oxazolidinone, 3-[(2S,4S)-4-azido-2-(1-methylethyl)-1-oxo-4-[(2S,4S)-tetrahydro-4-(1-methylethyl)-5-oxo-2-furanyl]butyl]-4-(phenylmethyl)-, (4S)-
CAS Number:
173154-01-3
Molecular Formula:
C24H32N4O5
Molecular Weight:
456.5347
IUPAC Name:
(4S)-3-[(2S,4S)-4-azido-4-[(2S,4S)-5-oxo-4-propan-2-yloxolan-2-yl]-2-propan-2-ylbutanoyl]-4-benzyl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C24H32N4O5/c1-14(2)18(11-20(26-27-25)21-12-19(15(3)4)23(30)33-21)22(29)28-17(13-32-24(28)31)10-16-8-6-5-7-9-16/h5-9,14-15,17-21H,10-13H2,1-4H3/t17-,18-,19-,20-,21-/m0/s1
InChI Key:
AZMFFFCHYNXWLN-SXYSDOLCSA-N
SMILES:
CC([C@@H](C(=O)N1[C@H](COC1=O)Cc1ccccc1)C[C@@H]([C@@H]1C[C@H](C(=O)O1)C(C)C)N=[N+]=[N-])C
EC Number:
605-665-6
Properties
Complexity:
773
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
456.237g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
456.543g/mol
Monoisotopic Mass:
456.237g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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