D360-0195 Screening compound: methyl 2-(2-{[3-cyano-6-(furan-2-yl)pyridin-2-yl]sulfanyl}acetamido)benzoate

D360-0195 Screening compound: methyl 2-(2-{[3-cyano-6-(furan-2-yl)pyridin-2-yl]sulfanyl}acetamido)benzoate
D360-0195 Screening compound: methyl 2-(2-{[3-cyano-6-(furan-2-yl)pyridin-2-yl]sulfanyl}acetamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D360-0195
methyl 2-(2-{[3-cyano-6-(furan-2-yl)pyridin-2-yl]sulfanyl}acetamido)benzoate

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

D360-0195

Molecular Formula

C20H15N3O4S (C20 H15 N3 O4 S)

Compound Name

methyl 2-(2-{[3-cyano-6-(furan-2-yl)pyridin-2-yl]sulfanyl}acetamido)benzoate

IUPAC name

methyl 2-(2-{[3-cyano-6-(furan-2-yl)pyridin-2-yl]sulfanyl}acetamido)benzoate

SMILES

COC(c(cccc1)c1NC(CSc1nc(-c2ccco2)ccc1C#N)=O)=O

InChI

InChI=1S/C20H15N3O4S/c1-26-20(25)14-5-2-3-6-15(14)22-18(24)12-28-19-13(11-21)8-9-16(23-19)17-7-4-10-27-17/h2-10H,12H2,1H3,(H,22,24)

InChI Key

OQGJIUVUNRJAGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10087557

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.42

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.347

Distribution Coefficient, logD

3.332

Water Solubility, LogSw

-3.78

Polar Surface Area

77.703

Acid Dissociation Constant (pKa)

8.84

Base Dissociation Constant (pKb)

-2.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with D360-0195 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D360-0195?
Check Price and Availability of D360-0195, 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 D360-0195 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D360-0195
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D360-0195
  • 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 D360-0195 available by request