L289-0003 Screening compound: N-(2,5-difluorophenyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Chemical Structure Depiction of ChemDiv screening compound L289-0003
N-(2,5-difluorophenyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
L289-0003
Molecular Formula
C15H10F2N2O3 (C15 H10 F2 N2 O3)
Compound Name
N-(2,5-difluorophenyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
IUPAC name
N-(25-difluorophenyl)-3-oxo-34-dihydro-2H-14-benzoxazine-2-carboxamide
SMILES
O=C(C1Oc(cccc2)c2NC1=O)Nc(cc(cc1)F)c1F
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
304.25
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
2.450
Distribution Coefficient, logD
2.423
Water Solubility, LogSw
-2.99
Polar Surface Area
55.192
Acid Dissociation Constant (pKa)
8.59
Base Dissociation Constant (pKb)
-2.88
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
6.70
L289-0003 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Antiviral Library (67538 compounds)
Protein-Protein Interaction Library (218420 compounds)
Targeted Diversity Library (40567 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with L289-0003 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)