C797-1515 Screening compound: N~1~-(2,5-dimethoxybenzyl)-2-{[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]amino}acetamide

C797-1515 Screening compound: N~1~-(2,5-dimethoxybenzyl)-2-{[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]amino}acetamide
C797-1515 Screening compound: N~1~-(2,5-dimethoxybenzyl)-2-{[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]amino}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C797-1515
N~1~-(2,5-dimethoxybenzyl)-2-{[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]amino}acetamide

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

C797-1515

Molecular Formula

C23H27N3O5S (C23 H27 N3 O5 S)

Compound Name

N~1~-(2,5-dimethoxybenzyl)-2-{[5-(3,4-dimethylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]amino}acetamide

IUPAC name

N-[(25-dimethoxyphenyl)methyl]-2-{[5-(34-dimethylphenyl)-4-methyl-11-dioxo-1lambda62-thiazol-3-yl]amino}acetamide

SMILES

CC(C(NCC(NCc(cc(cc1)OC)c1OC)=O)=N1)=C(c2cc(C)c(C)cc2)S1(=O)=O

InChI

InChI=1S/C23H27N3O5S/c1-14-6-7-17(10-15(14)2)22-16(3)23(26-32(22,28)29)25-13-21(27)24-12-18-11-19(30-4)8-9-20(18)31-5/h6-11H,12-13H2,1-5H3,(H,24,27)(H,25,26)

InChI Key

HWNSXLRYUHLHPM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14798742

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.783

Distribution Coefficient, logD

3.783

Water Solubility, LogSw

-4.00

Polar Surface Area

91.812

Acid Dissociation Constant (pKa)

12.00

Base Dissociation Constant (pKb)

-1.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

C797-1515 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C797-1515 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C797-1515?
Check Price and Availability of C797-1515, 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 C797-1515 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C797-1515
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C797-1515
  • 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 C797-1515 available by request