K780-0645 Screening compound: 4-(chloromethyl)-2-(2,4-dimethoxyphenyl)-5-methyl-1,3-oxazole

K780-0645 Screening compound: 4-(chloromethyl)-2-(2,4-dimethoxyphenyl)-5-methyl-1,3-oxazole
K780-0645 Screening compound: 4-(chloromethyl)-2-(2,4-dimethoxyphenyl)-5-methyl-1,3-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound K780-0645
4-(chloromethyl)-2-(2,4-dimethoxyphenyl)-5-methyl-1,3-oxazole

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

K780-0645

Molecular Formula

C13H14ClNO3 (C13 H14 ClNO3)

Compound Name

4-(chloromethyl)-2-(2,4-dimethoxyphenyl)-5-methyl-1,3-oxazole

IUPAC name

4-(chloromethyl)-2-(24-dimethoxyphenyl)-5-methyl-13-oxazole

SMILES

Cc1c(CCl)nc(-c(ccc(OC)c2)c2OC)o1

InChI

InChI=1S/C13H14ClNO3/c1-8-11(7-14)15-13(18-8)10-5-4-9(16-2)6-12(10)17-3/h4-6H,7H2,1-3H3

InChI Key

YXOAUKGFLSUASV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08457295

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

267.71

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.983

Distribution Coefficient, logD

2.983

Water Solubility, LogSw

-3.21

Polar Surface Area

33.535

Acid Dissociation Constant (pKa)

28.68

Base Dissociation Constant (pKb)

-0.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

K780-0645 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

KRAS-Targeted Library (16000 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Agro:
  • Agro
Targets:
  • Kinases
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with K780-0645 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K780-0645?
Check Price and Availability of K780-0645, 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 K780-0645 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K780-0645
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K780-0645
  • 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 K780-0645 available by request