0668-0092 Screening compound: 3-(diethylsulfamoyl)-N-(3-hydroxyphenyl)-4-methylbenzamide

0668-0092 Screening compound: 3-(diethylsulfamoyl)-N-(3-hydroxyphenyl)-4-methylbenzamide
0668-0092 Screening compound: 3-(diethylsulfamoyl)-N-(3-hydroxyphenyl)-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0668-0092
3-(diethylsulfamoyl)-N-(3-hydroxyphenyl)-4-methylbenzamide

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

0668-0092

Molecular Formula

C18H22N2O4S (C18 H22 N2 O4 S)

Compound Name

3-(diethylsulfamoyl)-N-(3-hydroxyphenyl)-4-methylbenzamide

IUPAC name

3-(diethylsulfamoyl)-N-(3-hydroxyphenyl)-4-methylbenzamide

SMILES

CCN(CC)S(c1c(C)ccc(C(Nc2cc(O)ccc2)=O)c1)(=O)=O

InChI

InChI=1S/C18H22N2O4S/c1-4-20(5-2)25(23,24)17-11-14(10-9-13(17)3)18(22)19-15-7-6-8-16(21)12-15/h6-12,21H,4-5H2,1-3H3,(H,19,22)

InChI Key

ZYULGDXRMYWMRI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00568679

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.850

Distribution Coefficient, logD

2.832

Water Solubility, LogSw

-2.98

Polar Surface Area

72.043

Acid Dissociation Constant (pKa)

8.78

Base Dissociation Constant (pKb)

-3.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

0668-0092 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0668-0092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0668-0092?
Check Price and Availability of 0668-0092, 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 0668-0092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0668-0092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0668-0092
  • 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 0668-0092 available by request