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A33903

CAT: 0013-GTR19211119-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19211119-03Size:100 mg
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Description
A33903 is a 1,4-benzodiazepine analog investigated as a respiratory syncytial virus (RSV) inhibitor. It exhibits moderate antiviral activity and favorable pharmacokinetics, supporting its use in both in vitro virology assays and in vivo preclinical RSV infection models.
CAS Number
70890-53-8
Smiles
N (C (C) =O) C1N=C (C=2C (NC1=O) =CC=CC2) C3=CC=CC=C3
Molecular Formula
C17H15N3O2
Molecular Weight
293.32
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)acetamide
CAS Number70890-53-8
PubChem CID2729103
IUPAC NameN-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)acetamide
Molecular FormulaC17H15N3O2
Molecular Weight293.32
XLogP1.7
Topological Polar Surface Area70.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count22
Formal Charge0
Complexity469
SMILES
CC(=O)NC1C(=O)NC2=CC=CC=C2C(=N1)C3=CC=CC=C3
InChI
InChI=1S/C17H15N3O2/c1-11(21)18-16-17(22)19-14-10-6-5-9-13(14)15(20-16)12-7-3-2-4-8-12/h2-10,16H,1H3,(H,18,21)(H,19,22)
InChIKey
MMXSDWJOQSEPSM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)acetamide
CAS: 70890-53-8
CID: 2729103
Formula: C17H15N3O2
MW: 293.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight293.32
XLogP31.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass293.116426730
Monoisotopic Mass293.116426730
Topological Polar Surface Area70.6 Ų
Heavy Atom Count22
Formal Charge0
Complexity469
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
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