J007-1448 Screening compound: N-(3-chloro-2-methylphenyl)-2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)pyrrolidine-1-carboxamide
Chemical Structure Depiction of ChemDiv screening compound J007-1448
N-(3-chloro-2-methylphenyl)-2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)pyrrolidine-1-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
J007-1448
Molecular Formula
C18H22ClN3O2 (C18 H22 ClN3 O2)
Compound Name
N-(3-chloro-2-methylphenyl)-2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)pyrrolidine-1-carboxamide
IUPAC name
N-(3-chloro-2-methylphenyl)-2-(5-ethyl-3-methyl-12-oxazol-4-yl)pyrrolidine-1-carboxamide
SMILES
CCc1c(C(CCC2)N2C(Nc2cccc(Cl)c2C)=O)c(C)no1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
347.84
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.194
Distribution Coefficient, logD
4.194
Water Solubility, LogSw
-4.28
Polar Surface Area
46.585
Acid Dissociation Constant (pKa)
12.67
Base Dissociation Constant (pKb)
-2.42
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
44.40
J007-1448 in Drug Discovery
Included in Screening Libraries
3CLpro Library (4801 compounds)
CORONAVIRUS Library (20774 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Peptidomimetic Library (37031 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Antiviral
- Infections
- Immune system
- PPI modulators
- PPI modulators
- Cyclic compounds
- Mimetics
References: we are preparing a list of scientific research reports with J007-1448 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)