3136-1004 Screening compound: 2,4-dimethoxy-N-[(4-sulfamoylphenyl)methyl]benzamide

3136-1004 Screening compound: 2,4-dimethoxy-N-[(4-sulfamoylphenyl)methyl]benzamide
3136-1004 Screening compound: 2,4-dimethoxy-N-[(4-sulfamoylphenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3136-1004
2,4-dimethoxy-N-[(4-sulfamoylphenyl)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

3136-1004

Molecular Formula

C16H18N2O5S (C16 H18 N2 O5 S)

Compound Name

2,4-dimethoxy-N-[(4-sulfamoylphenyl)methyl]benzamide

IUPAC name

n/a

SMILES

COc(cc1)cc(OC)c1C(NCc(cc1)ccc1S(N)(=O)=O)=O

InChI

InChI=1S/C16H18N2O5S/c1-22-12-5-8-14(15(9-12)23-2)16(19)18-10-11-3-6-13(7-4-11)24(17,20)21/h3-9H,10H2,1-2H3,(H,18,19)(H2,17,20,21)

InChI Key

KCXQKNXEDQKYHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02006818

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.4

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.370

Distribution Coefficient, logD

1.369

Water Solubility, LogSw

-2.41

Polar Surface Area

90.429

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

-3.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.75

3136-1004 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3136-1004 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3136-1004?
Check Price and Availability of 3136-1004, 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 3136-1004 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3136-1004
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3136-1004
  • 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 3136-1004 available by request