C625-0056 Screening compound: N-[(4-chlorophenyl)methyl]-3-methyl-1,2-oxazole-5-carboxamide

C625-0056 Screening compound: N-[(4-chlorophenyl)methyl]-3-methyl-1,2-oxazole-5-carboxamide
C625-0056 Screening compound: N-[(4-chlorophenyl)methyl]-3-methyl-1,2-oxazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C625-0056
N-[(4-chlorophenyl)methyl]-3-methyl-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

C625-0056

Molecular Formula

C12H11ClN2O2 (C12 H11 ClN2 O2)

Compound Name

N-[(4-chlorophenyl)methyl]-3-methyl-1,2-oxazole-5-carboxamide

IUPAC name

N-[(4-chlorophenyl)methyl]-3-methyl-12-oxazole-5-carboxamide

SMILES

Cc1noc(C(NCc(cc2)ccc2Cl)=O)c1

InChI

InChI=1S/C12H11ClN2O2/c1-8-6-11(17-15-8)12(16)14-7-9-2-4-10(13)5-3-9/h2-6H,7H2,1H3,(H,14,16)

InChI Key

BIHANCCRGKISAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08106076

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

250.68

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.274

Distribution Coefficient, logD

2.274

Water Solubility, LogSw

-3.38

Polar Surface Area

46.265

Acid Dissociation Constant (pKa)

11.24

Base Dissociation Constant (pKb)

-3.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

C625-0056 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

STING Agonist Library (5895 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Immune system
Agro:
  • Agro
Structure:
  • Fragments
Targets:
  • Others

References: we are preparing a list of scientific research reports with C625-0056 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C625-0056?
Check Price and Availability of C625-0056, 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 C625-0056 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C625-0056
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C625-0056
  • 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 C625-0056 available by request