8019-8378 Screening compound: N-{2-[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-4,6-dimethylthieno[2,3-b]pyridin-3-yl}benzamide

8019-8378 Screening compound: N-{2-[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-4,6-dimethylthieno[2,3-b]pyridin-3-yl}benzamide
8019-8378 Screening compound: N-{2-[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-4,6-dimethylthieno[2,3-b]pyridin-3-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-8378
N-{2-[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-4,6-dimethylthieno[2,3-b]pyridin-3-yl}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

8019-8378

Molecular Formula

C26H21N3O3S (C26 H21 N3 O3 S)

Compound Name

N-{2-[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]-4,6-dimethylthieno[2,3-b]pyridin-3-yl}benzamide

IUPAC name

N-{2-[3-(4-methoxyphenyl)-12-oxazol-5-yl]-46-dimethylthieno[23-b]pyridin-3-yl}benzamide

SMILES

Cc1c(c(NC(c2ccccc2)=O)c(-c2cc(-c(cc3)ccc3OC)no2)s2)c2nc(C)c1

InChI

InChI=1S/C26H21N3O3S/c1-15-13-16(2)27-26-22(15)23(28-25(30)18-7-5-4-6-8-18)24(33-26)21-14-20(29-32-21)17-9-11-19(31-3)12-10-17/h4-14H,1-3H3,(H,28,30)

InChI Key

APWYHOBDZGTJCI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12033812

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.704

Distribution Coefficient, logD

5.703

Water Solubility, LogSw

-5.85

Polar Surface Area

60.268

Acid Dissociation Constant (pKa)

11.13

Base Dissociation Constant (pKb)

4.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

8019-8378 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8019-8378 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-8378?
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What is the minimum amount of 8019-8378 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-8378
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-8378
  • 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 8019-8378 available by request