1812-0550 Screening compound: 2-chloro-5-iodo-N-(2-methyl-5-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)benzamide

1812-0550 Screening compound: 2-chloro-5-iodo-N-(2-methyl-5-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)benzamide
1812-0550 Screening compound: 2-chloro-5-iodo-N-(2-methyl-5-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1812-0550
2-chloro-5-iodo-N-(2-methyl-5-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)benzamide

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

1812-0550

Molecular Formula

C20H13ClIN3O2 (C20 H13 ClIN3 O2)

Compound Name

2-chloro-5-iodo-N-(2-methyl-5-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)benzamide

IUPAC name

2-chloro-5-iodo-N-(2-methyl-5-{[13]oxazolo[45-b]pyridin-2-yl}phenyl)benzamide

SMILES

Cc(ccc(-c1nc(nccc2)c2o1)c1)c1NC(c(cc(cc1)I)c1Cl)=O

InChI

InChI=1S/C20H13ClIN3O2/c1-11-4-5-12(20-25-18-17(27-20)3-2-8-23-18)9-16(11)24-19(26)14-10-13(22)6-7-15(14)21/h2-10H,1H3,(H,24,26)

InChI Key

CKTXWQAFRUFLLU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01063181

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

489.7

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.915

Distribution Coefficient, logD

5.913

Water Solubility, LogSw

-6.08

Polar Surface Area

49.816

Acid Dissociation Constant (pKa)

9.79

Base Dissociation Constant (pKb)

1.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

References: we are preparing a list of scientific research reports with 1812-0550 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1812-0550?
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What is the minimum amount of 1812-0550 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1812-0550
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1812-0550
  • 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 1812-0550 available by request