L309-0552 Screening compound: N-(5-chloro-2-methoxyphenyl)-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide

L309-0552 Screening compound: N-(5-chloro-2-methoxyphenyl)-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
L309-0552 Screening compound: N-(5-chloro-2-methoxyphenyl)-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L309-0552
N-(5-chloro-2-methoxyphenyl)-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-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

L309-0552

Molecular Formula

C20H19ClN4O6S (C20 H19 ClN4 O6 S)

Compound Name

N-(5-chloro-2-methoxyphenyl)-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide

IUPAC name

N-(5-chloro-2-methoxyphenyl)-4-[(5-ethyl-124-oxadiazol-3-yl)methyl]-3-oxo-34-dihydro-2H-14-benzoxazine-6-sulfonamide

SMILES

CCc1nc(CN2c(cc(cc3)S(Nc(cc(cc4)Cl)c4OC)(=O)=O)c3OCC2=O)no1

InChI

InChI=1S/C20H19ClN4O6S/c1-3-19-22-18(23-31-19)10-25-15-9-13(5-7-17(15)30-11-20(25)26)32(27,28)24-14-8-12(21)4-6-16(14)29-2/h4-9,24H,3,10-11H2,1-2H3

InChI Key

YOGJOOBUVRPYPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27244080

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.91

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.015

Distribution Coefficient, logD

1.897

Water Solubility, LogSw

-3.52

Polar Surface Area

104.256

Acid Dissociation Constant (pKa)

6.32

Base Dissociation Constant (pKb)

-4.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

L309-0552 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L309-0552 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L309-0552?
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What is the minimum amount of L309-0552 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L309-0552
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L309-0552
  • 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 L309-0552 available by request