3821-4202 Screening compound: 3-(4-chloro-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-1-(3-methoxybenzoyl)thiourea

3821-4202 Screening compound: 3-(4-chloro-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-1-(3-methoxybenzoyl)thiourea
3821-4202 Screening compound: 3-(4-chloro-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-1-(3-methoxybenzoyl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound 3821-4202
3-(4-chloro-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-1-(3-methoxybenzoyl)thiourea

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

3821-4202

Molecular Formula

C21H15ClN4O3S (C21 H15 ClN4 O3 S)

Compound Name

3-(4-chloro-3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-1-(3-methoxybenzoyl)thiourea

IUPAC name

3-(4-chloro-3-{[13]oxazolo[45-b]pyridin-2-yl}phenyl)-1-(3-methoxybenzoyl)thiourea

SMILES

COc1cccc(C(NC(Nc(cc2)cc(-c3nc(nccc4)c4o3)c2Cl)=S)=O)c1

InChI

InChI=1S/C21H15ClN4O3S/c1-28-14-5-2-4-12(10-14)19(27)26-21(30)24-13-7-8-16(22)15(11-13)20-25-18-17(29-20)6-3-9-23-18/h2-11H,1H3,(H2,24,26,27,30)

InChI Key

RZLFAXKHCOSBRE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02630745

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.89

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.772

Distribution Coefficient, logD

4.772

Water Solubility, LogSw

-5.01

Polar Surface Area

67.968

Acid Dissociation Constant (pKa)

10.94

Base Dissociation Constant (pKb)

1.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

References: we are preparing a list of scientific research reports with 3821-4202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3821-4202?
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What is the minimum amount of 3821-4202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3821-4202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3821-4202
  • 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 3821-4202 available by request