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RN-18

CAT: 0013-GTR19174208-01Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19174208-01Size:1 ml x 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
RN-18
CAS Number
431980-38-0
Product Name Alternative
Human immunodeficiency virus, Inhibitor, HIV, HIV Protease, HIV-1, HIVProtease, nonpermissive H9 cell, inhibit, RN18, RN-18, RN 18
Field of Research
Infectious Disease & Virology, Protein Biochemistry
Purity
97.21% (May vary between batches)
Solubility
DMSO:97 mg/mL (254.98 mM)
Smiles
COc1ccccc1NC (=O) c1ccccc1Sc1ccc (cc1) [N+] ([O-]) =O
Molecular Formula
C20H16N2O4S
Molecular Weight
380.42
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-(4-Nitrophenylthio)-N-(2-methoxyphenyl)benzamide
CAS Number431980-38-0
PubChem CID1317590
IUPAC NameN-(2-methoxyphenyl)-2-(4-nitrophenyl)sulfanylbenzamide
Molecular FormulaC20H16N2O4S
Molecular Weight380.4
XLogP4.6
Topological Polar Surface Area109
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count27
Formal Charge0
Complexity505
SMILES
COC1=CC=CC=C1NC(=O)C2=CC=CC=C2SC3=CC=C(C=C3)[N+](=O)[O-]
InChI
InChI=1S/C20H16N2O4S/c1-26-18-8-4-3-7-17(18)21-20(23)16-6-2-5-9-19(16)27-15-12-10-14(11-13-15)22(24)25/h2-13H,1H3,(H,21,23)
InChIKey
JKNUDHUHXMELIJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(4-Nitrophenylthio)-N-(2-methoxyphenyl)benzamide
CAS: 431980-38-0
CID: 1317590
Formula: C20H16N2O4S
MW: 380.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight380.4
XLogP34.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass380.08307817
Monoisotopic Mass380.08307817
Topological Polar Surface Area109 Ų
Heavy Atom Count27
Formal Charge0
Complexity505
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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