D526-0037 Screening compound: methyl 4-{3-methyl-5-oxo-4H,5H,6H,7H,8H,9H-[1,2]oxazolo[5,4-b]quinolin-4-yl}benzoate

D526-0037 Screening compound: methyl 4-{3-methyl-5-oxo-4H,5H,6H,7H,8H,9H-[1,2]oxazolo[5,4-b]quinolin-4-yl}benzoate
D526-0037 Screening compound: methyl 4-{3-methyl-5-oxo-4H,5H,6H,7H,8H,9H-[1,2]oxazolo[5,4-b]quinolin-4-yl}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D526-0037
methyl 4-{3-methyl-5-oxo-4H,5H,6H,7H,8H,9H-[1,2]oxazolo[5,4-b]quinolin-4-yl}benzoate

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

D526-0037

Molecular Formula

C19H18N2O4 (C19 H18 N2 O4)

Compound Name

methyl 4-{3-methyl-5-oxo-4H,5H,6H,7H,8H,9H-[1,2]oxazolo[5,4-b]quinolin-4-yl}benzoate

IUPAC name

methyl 4-{3-methyl-5-oxo-4H5H6H7H8H9H-[12]oxazolo[54-b]quinolin-4-yl}benzoate

SMILES

Cc1noc2c1C(c(cc1)ccc1C(OC)=O)C(C(CCC1)=O)=C1N2

InChI

InChI=1S/C19H18N2O4/c1-10-15-16(11-6-8-12(9-7-11)19(23)24-2)17-13(4-3-5-14(17)22)20-18(15)25-21-10/h6-9,16,20H,3-5H2,1-2H3/t16-/m1/s1

InChI Key

UOPSCFTWGGBLTN-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD09856564

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.890

Distribution Coefficient, logD

1.094

Water Solubility, LogSw

-3.46

Polar Surface Area

66.884

Acid Dissociation Constant (pKa)

5.61

Base Dissociation Constant (pKb)

-7.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.60

D526-0037 in Drug Discovery

Included in Screening Libraries

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

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 D526-0037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D526-0037?
Check Price and Availability of D526-0037, 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 D526-0037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D526-0037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D526-0037
  • 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 D526-0037 available by request