V014-4571 Screening compound: N-(5-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide

V014-4571 Screening compound: N-(5-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide
V014-4571 Screening compound: N-(5-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-4571
N-(5-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide

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

V014-4571

Molecular Formula

C17H14ClN3O2S2 (C17 H14 ClN3 O2 S2)

Compound Name

N-(5-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide

IUPAC name

N-(5-{[(2-chlorophenyl)methyl]sulfanyl}-134-thiadiazol-2-yl)-3-methoxybenzamide

SMILES

COc1cccc(C(Nc2nnc(SCc(cccc3)c3Cl)s2)=O)c1

InChI

InChI=1S/C17H14ClN3O2S2/c1-23-13-7-4-6-11(9-13)15(22)19-16-20-21-17(25-16)24-10-12-5-2-3-8-14(12)18/h2-9H,10H2,1H3,(H,19,20,22)

InChI Key

UXFQKGDQPLVQRS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05935104

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

391.9

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.210

Distribution Coefficient, logD

5.199

Water Solubility, LogSw

-5.74

Polar Surface Area

53.508

Acid Dissociation Constant (pKa)

8.97

Base Dissociation Constant (pKb)

-4.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

References: we are preparing a list of scientific research reports with V014-4571 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-4571?
Check Price and Availability of V014-4571, 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 V014-4571 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-4571
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-4571
  • 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 V014-4571 available by request