E157-7861 Screening compound: N-{5-[benzyl(methyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}-2-phenoxybutanamide

E157-7861 Screening compound: N-{5-[benzyl(methyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}-2-phenoxybutanamide
E157-7861 Screening compound: N-{5-[benzyl(methyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}-2-phenoxybutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-7861
N-{5-[benzyl(methyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}-2-phenoxybutanamide

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

E157-7861

Molecular Formula

C20H22N4O4S2 (C20 H22 N4 O4 S2)

Compound Name

N-{5-[benzyl(methyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}-2-phenoxybutanamide

IUPAC name

N-{5-[benzyl(methyl)sulfamoyl]-134-thiadiazol-2-yl}-2-phenoxybutanamide

SMILES

CCC(C(Nc(s1)nnc1S(N(C)Cc1ccccc1)(=O)=O)=O)Oc1ccccc1

InChI

InChI=1S/C20H22N4O4S2/c1-3-17(28-16-12-8-5-9-13-16)18(25)21-19-22-23-20(29-19)30(26,27)24(2)14-15-10-6-4-7-11-15/h4-13,17H,3,14H2,1-2H3,(H,21,22,25)/t17-/m0/s1

InChI Key

ALJFQLXUQXDGLS-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD14844381

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.55

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.289

Distribution Coefficient, logD

3.596

Water Solubility, LogSw

-4.18

Polar Surface Area

85.886

Acid Dissociation Constant (pKa)

6.81

Base Dissociation Constant (pKb)

-6.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with E157-7861 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-7861?
Check Price and Availability of E157-7861, 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 E157-7861 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-7861
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-7861
  • 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 E157-7861 available by request