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U-97456

CAT: 0013-GTR19274146-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19274146-01Size:10 mg
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Description
U-97456 is an N-hydroxyethyl derivative exhibiting antibacterial activity. It demonstrates a minimum inhibitory concentration (MIC) of less than 50 μg/mL against Mycobacterium tuberculosis (M. tuberculosis) H37Rv. U-97456 is applicable in infection research.
CAS Number
129487-43-0
Smiles
C (CO) (=O) N1C=2C (=CC (=CC2) N3C[C@H] (CNC (C) =O) OC3=O) CC1
Molecular Formula
C16H19N3O5
Molecular Weight
333.34
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-[[(5S)-3-[1-(2-hydroxyacetyl)-2,3-dihydroindol-5-yl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CAS Number129487-43-0
PubChem CID9797703
IUPAC NameN-[[(5S)-3-[1-(2-hydroxyacetyl)-2,3-dihydroindol-5-yl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
Molecular FormulaC16H19N3O5
Molecular Weight333.34
XLogP-0.4
Topological Polar Surface Area99.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count24
Formal Charge0
Complexity526
SMILES
CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC3=C(C=C2)N(CC3)C(=O)CO
InChI
InChI=1S/C16H19N3O5/c1-10(21)17-7-13-8-19(16(23)24-13)12-2-3-14-11(6-12)4-5-18(14)15(22)9-20/h2-3,6,13,20H,4-5,7-9H2,1H3,(H,17,21)/t13-/m0/s1
InChIKey
WKRFERLNJPHDOT-ZDUSSCGKSA-N
Chemical Structure
2D Structure
2D structure of N-[[(5S)-3-[1-(2-hydroxyacetyl)-2,3-dihydroindol-5-yl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CAS: 129487-43-0
CID: 9797703
Formula: C16H19N3O5
MW: 333.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight333.34
XLogP3-0.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass333.13247072
Monoisotopic Mass333.13247072
Topological Polar Surface Area99.2 Ų
Heavy Atom Count24
Formal Charge0
Complexity526
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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