D339-0101 Screening compound: N-(2-chlorophenyl)-4-(prop-2-en-1-yloxy)-N-[(thiophen-2-yl)methyl]benzamide

D339-0101 Screening compound: N-(2-chlorophenyl)-4-(prop-2-en-1-yloxy)-N-[(thiophen-2-yl)methyl]benzamide
D339-0101 Screening compound: N-(2-chlorophenyl)-4-(prop-2-en-1-yloxy)-N-[(thiophen-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D339-0101
N-(2-chlorophenyl)-4-(prop-2-en-1-yloxy)-N-[(thiophen-2-yl)methyl]benzamide

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

D339-0101

Molecular Formula

C21H18ClNO2S (C21 H18 ClNO2 S)

Compound Name

N-(2-chlorophenyl)-4-(prop-2-en-1-yloxy)-N-[(thiophen-2-yl)methyl]benzamide

IUPAC name

N-(2-chlorophenyl)-4-(prop-2-en-1-yloxy)-N-[(thiophen-2-yl)methyl]benzamide

SMILES

C=CCOc(cc1)ccc1C(N(Cc1cccs1)c(cccc1)c1Cl)=O

InChI

InChI=1S/C21H18ClNO2S/c1-2-13-25-17-11-9-16(10-12-17)21(24)23(15-18-6-5-14-26-18)20-8-4-3-7-19(20)22/h2-12,14H,1,13,15H2

InChI Key

XBDHSFPKBMYKOT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12916699

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.9

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.302

Distribution Coefficient, logD

5.302

Water Solubility, LogSw

-5.87

Polar Surface Area

23.725

Acid Dissociation Constant (pKa)

31.18

Base Dissociation Constant (pKb)

-6.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

References: we are preparing a list of scientific research reports with D339-0101 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D339-0101?
Check Price and Availability of D339-0101, 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 D339-0101 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D339-0101
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D339-0101
  • 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 D339-0101 available by request