0783-0185 Screening compound: N-[(Z)-[(4-chlorobenzenesulfonyl)imino](phenyl)methyl]ethoxycarbothioamide

0783-0185 Screening compound: N-[(Z)-[(4-chlorobenzenesulfonyl)imino](phenyl)methyl]ethoxycarbothioamide
0783-0185 Screening compound: N-[(Z)-[(4-chlorobenzenesulfonyl)imino](phenyl)methyl]ethoxycarbothioamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0783-0185
N-[(Z)-[(4-chlorobenzenesulfonyl)imino](phenyl)methyl]ethoxycarbothioamide

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

0783-0185

Molecular Formula

C16H15ClN2O3S2 (C16 H15 ClN2 O3 S2)

Compound Name

N-[(Z)-[(4-chlorobenzenesulfonyl)imino](phenyl)methyl]ethoxycarbothioamide

IUPAC name

N-[(Z)-[(4-chlorobenzenesulfonyl)imino](phenyl)methyl]ethoxycarbothioamide

SMILES

CCOC(N/C(/c1ccccc1)=N\S(c(cc1)ccc1Cl)(=O)=O)=S

InChI

InChI=1S/C16H15ClN2O3S2/c1-2-22-16(23)18-15(12-6-4-3-5-7-12)19-24(20,21)14-10-8-13(17)9-11-14/h3-11H,2H2,1H3,(H,18,19,23)

InChI Key

LJXFUHJPSZUTAQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00720429

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.89

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.156

Distribution Coefficient, logD

3.173

Water Solubility, LogSw

-4.53

Polar Surface Area

57.192

Acid Dissociation Constant (pKa)

6.46

Base Dissociation Constant (pKb)

-0.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

0783-0185 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0783-0185 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0783-0185?
Check Price and Availability of 0783-0185, 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 0783-0185 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0783-0185
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0783-0185
  • 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 0783-0185 available by request