Y031-9214 Screening compound: ethyl 1-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperidine-4-carboxylate

Y031-9214 Screening compound: ethyl 1-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperidine-4-carboxylate
Y031-9214 Screening compound: ethyl 1-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-9214
ethyl 1-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperidine-4-carboxylate

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

Y031-9214

Molecular Formula

C19H20Cl2N2O4 (C19 H20 Cl2 N2 O4)

Compound Name

ethyl 1-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperidine-4-carboxylate

IUPAC name

ethyl 1-[3-(26-dichlorophenyl)-5-methyl-12-oxazole-4-carbonyl]piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(c1c(C)onc1-c(c(Cl)ccc1)c1Cl)=O)=O

InChI

InChI=1S/C19H20Cl2N2O4/c1-3-26-19(25)12-7-9-23(10-8-12)18(24)15-11(2)27-22-17(15)16-13(20)5-4-6-14(16)21/h4-6,12H,3,7-10H2,1-2H3

InChI Key

TXMNBVMBKNJRTD-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.28

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.310

Distribution Coefficient, logD

3.310

Water Solubility, LogSw

-3.77

Polar Surface Area

59.601

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

-2.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

References: we are preparing a list of scientific research reports with Y031-9214 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-9214?
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What is the minimum amount of Y031-9214 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-9214
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-9214
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of Y031-9214 available by request