C651-0884 Screening compound: N-cyclohexyl-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
Chemical Structure Depiction of ChemDiv screening compound C651-0884
N-cyclohexyl-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-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
C651-0884
Molecular Formula
C18H24N2O4 (C18 H24 N2 O4)
Compound Name
N-cyclohexyl-3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
IUPAC name
N-cyclohexyl-3-(34-dimethoxyphenyl)-45-dihydro-12-oxazole-5-carboxamide
SMILES
COc(ccc(C(C1)=NOC1C(NC1CCCCC1)=O)c1)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
332.4
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.917
Distribution Coefficient, logD
2.917
Water Solubility, LogSw
-3.27
Polar Surface Area
62.231
Acid Dissociation Constant (pKa)
14.97
Base Dissociation Constant (pKb)
-0.57
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
55.60
C651-0884 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with C651-0884 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)