D376-0748 Screening compound: ethyl 2-{2-[(4-ethylphenoxy)methyl]-4-methyl-1,3-thiazole-5-amido}-4-methyl-1,3-thiazole-5-carboxylate

D376-0748 Screening compound: ethyl 2-{2-[(4-ethylphenoxy)methyl]-4-methyl-1,3-thiazole-5-amido}-4-methyl-1,3-thiazole-5-carboxylate
D376-0748 Screening compound: ethyl 2-{2-[(4-ethylphenoxy)methyl]-4-methyl-1,3-thiazole-5-amido}-4-methyl-1,3-thiazole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D376-0748
ethyl 2-{2-[(4-ethylphenoxy)methyl]-4-methyl-1,3-thiazole-5-amido}-4-methyl-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

D376-0748

Molecular Formula

C21H23N3O4S2 (C21 H23 N3 O4 S2)

Compound Name

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

IUPAC name

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

SMILES

CCc(cc1)ccc1OCc1nc(C)c(C(Nc2nc(C)c(C(OCC)=O)s2)=O)s1

InChI

InChI=1S/C21H23N3O4S2/c1-5-14-7-9-15(10-8-14)28-11-16-22-12(3)17(29-16)19(25)24-21-23-13(4)18(30-21)20(26)27-6-2/h7-10H,5-6,11H2,1-4H3,(H,23,24,25)

InChI Key

TULXKELSVCPYIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14825623

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.291

Distribution Coefficient, logD

4.492

Water Solubility, LogSw

-5.19

Polar Surface Area

73.012

Acid Dissociation Constant (pKa)

6.68

Base Dissociation Constant (pKb)

1.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

D376-0748 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D376-0748 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D376-0748?
Check Price and Availability of D376-0748, 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 D376-0748 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D376-0748
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D376-0748
  • 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 D376-0748 available by request