8019-3789 Screening compound: 5-chloro-N-[2-(3-methoxyphenoxy)ethyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide

8019-3789 Screening compound: 5-chloro-N-[2-(3-methoxyphenoxy)ethyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
8019-3789 Screening compound: 5-chloro-N-[2-(3-methoxyphenoxy)ethyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-3789
5-chloro-N-[2-(3-methoxyphenoxy)ethyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide

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

8019-3789

Molecular Formula

C17H17ClN2O6S (C17 H17 ClN2 O6 S)

Compound Name

5-chloro-N-[2-(3-methoxyphenoxy)ethyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide

IUPAC name

5-chloro-N-[2-(3-methoxyphenoxy)ethyl]-3-methyl-2-oxo-23-dihydro-13-benzoxazole-6-sulfonamide

SMILES

CN(c(c(O1)c2)cc(Cl)c2S(NCCOc2cc(OC)ccc2)(=O)=O)C1=O

InChI

InChI=1S/C17H17ClN2O6S/c1-20-14-9-13(18)16(10-15(14)26-17(20)21)27(22,23)19-6-7-25-12-5-3-4-11(8-12)24-2/h3-5,8-10,19H,6-7H2,1-2H3

InChI Key

KIKGALXIMOAGKH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09064608

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.85

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.993

Distribution Coefficient, logD

2.993

Water Solubility, LogSw

-3.68

Polar Surface Area

79.666

Acid Dissociation Constant (pKa)

10.73

Base Dissociation Constant (pKb)

-5.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

8019-3789 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8019-3789 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-3789?
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What is the minimum amount of 8019-3789 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-3789
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-3789
  • 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 8019-3789 available by request