C523-2418 Screening compound: ethyl 4-[2-({[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)acetamido]piperidine-1-carboxylate

C523-2418 Screening compound: ethyl 4-[2-({[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)acetamido]piperidine-1-carboxylate
C523-2418 Screening compound: ethyl 4-[2-({[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)acetamido]piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C523-2418
ethyl 4-[2-({[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)acetamido]piperidine-1-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

C523-2418

Molecular Formula

C22H29N3O4S (C22 H29 N3 O4 S)

Compound Name

ethyl 4-[2-({[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)acetamido]piperidine-1-carboxylate

IUPAC name

ethyl 4-[2-({[5-methyl-2-(4-methylphenyl)-13-oxazol-4-yl]methyl}sulfanyl)acetamido]piperidine-1-carboxylate

SMILES

CCOC(N(CC1)CCC1NC(CSCc1c(C)oc(-c2ccc(C)cc2)n1)=O)=O

InChI

InChI=1S/C22H29N3O4S/c1-4-28-22(27)25-11-9-18(10-12-25)23-20(26)14-30-13-19-16(3)29-21(24-19)17-7-5-15(2)6-8-17/h5-8,18H,4,9-14H2,1-3H3,(H,23,26)

InChI Key

GUHCORDIDIUATJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14766370

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.824

Distribution Coefficient, logD

3.824

Water Solubility, LogSw

-3.80

Polar Surface Area

65.066

Acid Dissociation Constant (pKa)

15.92

Base Dissociation Constant (pKb)

0.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

C523-2418 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C523-2418 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C523-2418?
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What is the minimum amount of C523-2418 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C523-2418
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C523-2418
  • 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 C523-2418 available by request