3792-1163 Screening compound: 1-(3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-3-(3,4,5-trimethoxybenzoyl)thiourea

3792-1163 Screening compound: 1-(3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-3-(3,4,5-trimethoxybenzoyl)thiourea
3792-1163 Screening compound: 1-(3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-3-(3,4,5-trimethoxybenzoyl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound 3792-1163
1-(3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-3-(3,4,5-trimethoxybenzoyl)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

3792-1163

Molecular Formula

C23H20N4O5S (C23 H20 N4 O5 S)

Compound Name

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

IUPAC name

1-(3-{[13]oxazolo[45-b]pyridin-2-yl}phenyl)-3-(345-trimethoxybenzoyl)thiourea

SMILES

COc1cc(C(NC(Nc2cc(-c3nc(nccc4)c4o3)ccc2)=S)=O)cc(OC)c1OC

InChI

InChI=1S/C23H20N4O5S/c1-29-17-11-14(12-18(30-2)19(17)31-3)21(28)27-23(33)25-15-7-4-6-13(10-15)22-26-20-16(32-22)8-5-9-24-20/h4-12H,1-3H3,(H2,25,27,28,33)

InChI Key

BKQRMMLYFRFOCM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02734567

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.5

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.983

Distribution Coefficient, logD

3.983

Water Solubility, LogSw

-4.14

Polar Surface Area

83.402

Acid Dissociation Constant (pKa)

11.85

Base Dissociation Constant (pKb)

1.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

References: we are preparing a list of scientific research reports with 3792-1163 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3792-1163?
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What is the minimum amount of 3792-1163 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3792-1163
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3792-1163
  • 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 3792-1163 available by request