J007-0720 Screening compound: ethyl 2-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolidine-1-carbonyl]amino}acetate
Chemical Structure Depiction of ChemDiv screening compound J007-0720
ethyl 2-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolidine-1-carbonyl]amino}acetate
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
J007-0720
Molecular Formula
C14H21N3O4 (C14 H21 N3 O4)
Compound Name
ethyl 2-{[2-(3,5-dimethyl-1,2-oxazol-4-yl)pyrrolidine-1-carbonyl]amino}acetate
IUPAC name
ethyl 2-{[2-(35-dimethyl-12-oxazol-4-yl)pyrrolidine-1-carbonyl]amino}acetate
SMILES
CCOC(CNC(N(CCC1)C1c1c(C)onc1C)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
295.34
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
1.065
Distribution Coefficient, logD
1.065
Water Solubility, LogSw
-1.52
Polar Surface Area
69.287
Acid Dissociation Constant (pKa)
16.07
Base Dissociation Constant (pKb)
-3.07
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
64.30
J007-0720 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
Targeted Diversity Library (40567 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Peptidomimetic Library (37031 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- Cyclic compounds
- Mimetics
References: we are preparing a list of scientific research reports with J007-0720 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)