4390-0039 Screening compound: N-(2,3-dimethylphenyl)-4-(N-methyl4-methylbenzenesulfonamido)butanamide

4390-0039 Screening compound: N-(2,3-dimethylphenyl)-4-(N-methyl4-methylbenzenesulfonamido)butanamide
4390-0039 Screening compound: N-(2,3-dimethylphenyl)-4-(N-methyl4-methylbenzenesulfonamido)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4390-0039
N-(2,3-dimethylphenyl)-4-(N-methyl4-methylbenzenesulfonamido)butanamide

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

4390-0039

Molecular Formula

C20H26N2O3S (C20 H26 N2 O3 S)

Compound Name

N-(2,3-dimethylphenyl)-4-(N-methyl4-methylbenzenesulfonamido)butanamide

IUPAC name

N-(23-dimethylphenyl)-4-(N-methyl4-methylbenzenesulfonamido)butanamide

SMILES

Cc(cc1)ccc1S(N(C)CCCC(Nc1c(C)c(C)ccc1)=O)(=O)=O

InChI

InChI=1S/C20H26N2O3S/c1-15-10-12-18(13-11-15)26(24,25)22(4)14-6-9-20(23)21-19-8-5-7-16(2)17(19)3/h5,7-8,10-13H,6,9,14H2,1-4H3,(H,21,23)

InChI Key

JBIYUSDGIZZPFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02217599

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.494

Distribution Coefficient, logD

3.494

Water Solubility, LogSw

-3.73

Polar Surface Area

55.233

Acid Dissociation Constant (pKa)

12.47

Base Dissociation Constant (pKb)

1.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

4390-0039 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 4390-0039 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4390-0039?
Check Price and Availability of 4390-0039, 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 4390-0039 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4390-0039
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4390-0039
  • 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 4390-0039 available by request