P621-0340 Screening compound: 2,4-dimethyl-N-[(4-methylphenyl)methyl]-3-oxo-2H,3H,4H-pyrido[3,2-b][1,4]oxazine-2-carboxamide
Chemical Structure Depiction of ChemDiv screening compound P621-0340
2,4-dimethyl-N-[(4-methylphenyl)methyl]-3-oxo-2H,3H,4H-pyrido[3,2-b][1,4]oxazine-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
P621-0340
Molecular Formula
C18H19N3O3 (C18 H19 N3 O3)
Compound Name
2,4-dimethyl-N-[(4-methylphenyl)methyl]-3-oxo-2H,3H,4H-pyrido[3,2-b][1,4]oxazine-2-carboxamide
IUPAC name
24-dimethyl-N-[(4-methylphenyl)methyl]-3-oxo-2H3H4H-pyrido[32-b][14]oxazine-2-carboxamide
SMILES
CC1(C(NCc2ccc(C)cc2)=O)Oc2cccnc2N(C)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
325.37
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.185
Distribution Coefficient, logD
2.185
Water Solubility, LogSw
-2.59
Polar Surface Area
57.103
Acid Dissociation Constant (pKa)
12.49
Base Dissociation Constant (pKb)
2.95
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
27.80
P621-0340 in Drug Discovery
Included in Screening Libraries
Antiparasite Library (23996 compounds)
Ligand-Gated Ion Channels Library (3887 compounds)
Protein-Protein Interaction Library (218420 compounds)
SmartTM Library (51161 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
- Nervous system
- Eye
- Agro
- Ion Channels
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with P621-0340 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)