C226-2505 Screening compound: N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-(2-hydroxyphenyl)-1,2-oxazole-3-carboxamide

C226-2505 Screening compound: N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-(2-hydroxyphenyl)-1,2-oxazole-3-carboxamide
C226-2505 Screening compound: N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-(2-hydroxyphenyl)-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C226-2505
N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-(2-hydroxyphenyl)-1,2-oxazole-3-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

C226-2505

Molecular Formula

C22H18Cl2N4O3 (C22 H18 Cl2 N4 O3)

Compound Name

N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-(2-hydroxyphenyl)-1,2-oxazole-3-carboxamide

IUPAC name

N-{1-[(26-dichlorophenyl)methyl]-35-dimethyl-1H-pyrazol-4-yl}-5-(2-hydroxyphenyl)-12-oxazole-3-carboxamide

SMILES

Cc(n(Cc(c(Cl)ccc1)c1Cl)nc1C)c1NC(c1noc(-c(cccc2)c2O)c1)=O

InChI

InChI=1S/C22H18Cl2N4O3/c1-12-21(13(2)28(26-12)11-15-16(23)7-5-8-17(15)24)25-22(30)18-10-20(31-27-18)14-6-3-4-9-19(14)29/h3-10,29H,11H2,1-2H3,(H,25,30)

InChI Key

WWQFWAOKXVNDTQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09782752

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.667

Distribution Coefficient, logD

4.631

Water Solubility, LogSw

-4.49

Polar Surface Area

74.299

Acid Dissociation Constant (pKa)

8.46

Base Dissociation Constant (pKb)

-0.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

References: we are preparing a list of scientific research reports with C226-2505 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C226-2505?
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What is the minimum amount of C226-2505 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C226-2505
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C226-2505
  • 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 C226-2505 available by request