V028-6873 Screening compound: ethyl 2-{[5-(2,4-dichlorobenzamido)-1,3,4-thiadiazol-2-yl]sulfanyl}butanoate

V028-6873 Screening compound: ethyl 2-{[5-(2,4-dichlorobenzamido)-1,3,4-thiadiazol-2-yl]sulfanyl}butanoate
V028-6873 Screening compound: ethyl 2-{[5-(2,4-dichlorobenzamido)-1,3,4-thiadiazol-2-yl]sulfanyl}butanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-6873
ethyl 2-{[5-(2,4-dichlorobenzamido)-1,3,4-thiadiazol-2-yl]sulfanyl}butanoate

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

V028-6873

Molecular Formula

C15H15Cl2N3O3S2 (C15 H15 Cl2 N3 O3 S2)

Compound Name

ethyl 2-{[5-(2,4-dichlorobenzamido)-1,3,4-thiadiazol-2-yl]sulfanyl}butanoate

IUPAC name

ethyl 2-{[5-(24-dichlorobenzamido)-134-thiadiazol-2-yl]sulfanyl}butanoate

SMILES

CCC(C(OCC)=O)Sc1nnc(NC(c(ccc(Cl)c2)c2Cl)=O)s1

InChI

InChI=1S/C15H15Cl2N3O3S2/c1-3-11(13(22)23-4-2)24-15-20-19-14(25-15)18-12(21)9-6-5-8(16)7-10(9)17/h5-7,11H,3-4H2,1-2H3,(H,18,19,21)/t11-/m0/s1

InChI Key

PLJAEPHRGUMJCX-NSHDSACASA-N

MDL Number (MFCD)

MFCD19857950

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

420.34

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.445

Distribution Coefficient, logD

4.477

Water Solubility, LogSw

-5.98

Polar Surface Area

66.989

Acid Dissociation Constant (pKa)

6.48

Base Dissociation Constant (pKb)

-4.74

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

V028-6873 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V028-6873 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-6873?
Check Price and Availability of V028-6873, 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 V028-6873 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-6873
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-6873
  • 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 V028-6873 available by request