C527-1246 Screening compound: 2-({[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfinyl)-N~1~-(2-furylmethyl)acetamide

C527-1246 Screening compound: 2-({[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfinyl)-N~1~-(2-furylmethyl)acetamide
C527-1246 Screening compound: 2-({[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfinyl)-N~1~-(2-furylmethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C527-1246
2-({[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfinyl)-N~1~-(2-furylmethyl)acetamide

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

C527-1246

Molecular Formula

C18H17ClN2O4S (C18 H17 ClN2 O4 S)

Compound Name

2-({[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfinyl)-N~1~-(2-furylmethyl)acetamide

IUPAC name

n/a

SMILES

Cc1c(CS(CC(NCc2ccco2)=O)=O)nc(-c(cccc2)c2Cl)o1

InChI

InChI=1S/C18H19ClN2O4S/c1-12-16(21-18(25-12)14-6-2-3-7-15(14)19)10-26(23)11-17(22)20-9-13-5-4-8-24-13/h2-8H,9-11,26H2,1H3,(H,20,22)

InChI Key

GZRGMHYBJCMTHZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14766722

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.86

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.884

Distribution Coefficient, logD

2.884

Water Solubility, LogSw

-3.69

Polar Surface Area

65.353

Acid Dissociation Constant (pKa)

12.61

Base Dissociation Constant (pKb)

-1.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

C527-1246 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C527-1246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C527-1246?
Check Price and Availability of C527-1246, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C527-1246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C527-1246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C527-1246
  • 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 C527-1246 available by request