E786-0684 Screening compound: N-(3,4-DIMETHOXYPHENETHYL)-4-(3-METHYL-5-ISOXAZOLYL)-1-BENZENESULFONAMIDE

E786-0684 Screening compound: N-(3,4-DIMETHOXYPHENETHYL)-4-(3-METHYL-5-ISOXAZOLYL)-1-BENZENESULFONAMIDE
E786-0684 Screening compound: N-(3,4-DIMETHOXYPHENETHYL)-4-(3-METHYL-5-ISOXAZOLYL)-1-BENZENESULFONAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound E786-0684
N-(3,4-DIMETHOXYPHENETHYL)-4-(3-METHYL-5-ISOXAZOLYL)-1-BENZENESULFONAMIDE

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

E786-0684

Molecular Formula

C20H22N2O5S (C20 H22 N2 O5 S)

Compound Name

N-(3,4-DIMETHOXYPHENETHYL)-4-(3-METHYL-5-ISOXAZOLYL)-1-BENZENESULFONAMIDE

IUPAC name

n/a

SMILES

Cc1noc(-c(cc2)ccc2S(NCCc(cc2)cc(OC)c2OC)(=O)=O)c1

InChI

InChI=1S/C20H22N2O5S/c1-14-12-19(27-22-14)16-5-7-17(8-6-16)28(23,24)21-11-10-15-4-9-18(25-2)20(13-15)26-3/h4-9,12-13,21H,10-11H2,1-3H3

InChI Key

ZBJMBNJRWYUAHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14918686

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.47

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.094

Distribution Coefficient, logD

3.094

Water Solubility, LogSw

-3.41

Polar Surface Area

78.441

Acid Dissociation Constant (pKa)

11.63

Base Dissociation Constant (pKb)

-2.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with E786-0684 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E786-0684?
Check Price and Availability of E786-0684, 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 E786-0684 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E786-0684
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E786-0684
  • 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 E786-0684 available by request