V011-3800 Screening compound: N-{5-[(3,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide

V011-3800 Screening compound: N-{5-[(3,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide
V011-3800 Screening compound: N-{5-[(3,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-3800
N-{5-[(3,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide

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

V011-3800

Molecular Formula

C13H13Cl2N3OS2 (C13 H13 Cl2 N3 OS2)

Compound Name

N-{5-[(3,4-dichlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide

IUPAC name

N-(5-{[(34-dichlorophenyl)methyl]sulfanyl}-134-thiadiazol-2-yl)-2-methylpropanamide

SMILES

CC(C)C(Nc1nnc(SCc(cc2)cc(Cl)c2Cl)s1)=O

InChI

InChI=1S/C13H13Cl2N3OS2/c1-7(2)11(19)16-12-17-18-13(21-12)20-6-8-3-4-9(14)10(15)5-8/h3-5,7H,6H2,1-2H3,(H,16,17,19)

InChI Key

ZMNJPJOQXBQXFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04341127

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.226

Distribution Coefficient, logD

5.223

Water Solubility, LogSw

-5.74

Polar Surface Area

46.236

Acid Dissociation Constant (pKa)

9.62

Base Dissociation Constant (pKb)

-4.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.77

References: we are preparing a list of scientific research reports with V011-3800 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-3800?
Check Price and Availability of V011-3800, 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 V011-3800 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-3800
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-3800
  • 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 V011-3800 available by request