V002-7819 Screening compound: ethyl 4-[(5-hexanamido-1,3,4-thiadiazol-2-yl)sulfanyl]butanoate

V002-7819 Screening compound: ethyl 4-[(5-hexanamido-1,3,4-thiadiazol-2-yl)sulfanyl]butanoate
V002-7819 Screening compound: ethyl 4-[(5-hexanamido-1,3,4-thiadiazol-2-yl)sulfanyl]butanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-7819
ethyl 4-[(5-hexanamido-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

V002-7819

Molecular Formula

C14H23N3O3S2 (C14 H23 N3 O3 S2)

Compound Name

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

IUPAC name

ethyl 4-[(5-hexanamido-134-thiadiazol-2-yl)sulfanyl]butanoate

SMILES

CCCCCC(Nc1nnc(SCCCC(OCC)=O)s1)=O

InChI

InChI=1S/C14H23N3O3S2/c1-3-5-6-8-11(18)15-13-16-17-14(22-13)21-10-7-9-12(19)20-4-2/h3-10H2,1-2H3,(H,15,16,18)

InChI Key

ZKUFQQJIAGECRH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19857524

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.713

Distribution Coefficient, logD

3.709

Water Solubility, LogSw

-3.55

Polar Surface Area

66.452

Acid Dissociation Constant (pKa)

9.42

Base Dissociation Constant (pKb)

-3.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

71.40

References: we are preparing a list of scientific research reports with V002-7819 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-7819?
Check Price and Availability of V002-7819, 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 V002-7819 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-7819
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-7819
  • 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 V002-7819 available by request