D376-0443 Screening compound: methyl 2-{2-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-1,3-thiazole-5-amido}-4-ethyl-1,3-thiazole-5-carboxylate

D376-0443 Screening compound: methyl 2-{2-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-1,3-thiazole-5-amido}-4-ethyl-1,3-thiazole-5-carboxylate
D376-0443 Screening compound: methyl 2-{2-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-1,3-thiazole-5-amido}-4-ethyl-1,3-thiazole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D376-0443
methyl 2-{2-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-1,3-thiazole-5-amido}-4-ethyl-1,3-thiazole-5-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

D376-0443

Molecular Formula

C20H20ClN3O4S2 (C20 H20 ClN3 O4 S2)

Compound Name

methyl 2-{2-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-1,3-thiazole-5-amido}-4-ethyl-1,3-thiazole-5-carboxylate

IUPAC name

methyl 2-{2-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-13-thiazole-5-amido}-4-ethyl-13-thiazole-5-carboxylate

SMILES

CCc1c(C(OC)=O)sc(NC(c2c(C)nc(COc(cc3)cc(C)c3Cl)s2)=O)n1

InChI

InChI=1S/C20H20ClN3O4S2/c1-5-14-17(19(26)27-4)30-20(23-14)24-18(25)16-11(3)22-15(29-16)9-28-12-6-7-13(21)10(2)8-12/h6-8H,5,9H2,1-4H3,(H,23,24,25)

InChI Key

IULHPYYBEICMBJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09540919

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.98

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.627

Distribution Coefficient, logD

4.845

Water Solubility, LogSw

-5.95

Polar Surface Area

74.121

Acid Dissociation Constant (pKa)

6.70

Base Dissociation Constant (pKb)

1.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

D376-0443 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D376-0443 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D376-0443?
Check Price and Availability of D376-0443, 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 D376-0443 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D376-0443
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D376-0443
  • 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 D376-0443 available by request