D344-7791 Screening compound: 3-fluoro-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide

D344-7791 Screening compound: 3-fluoro-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide
D344-7791 Screening compound: 3-fluoro-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D344-7791
3-fluoro-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-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

D344-7791

Molecular Formula

C21H15FN2O3 (C21 H15 FN2 O3)

Compound Name

3-fluoro-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide

IUPAC name

3-fluoro-N-[2-(4-methoxyphenyl)-13-benzoxazol-5-yl]benzamide

SMILES

COc(cc1)ccc1-c1nc(cc(cc2)NC(c3cccc(F)c3)=O)c2o1

InChI

InChI=1S/C21H15FN2O3/c1-26-17-8-5-13(6-9-17)21-24-18-12-16(7-10-19(18)27-21)23-20(25)14-3-2-4-15(22)11-14/h2-12H,1H3,(H,23,25)

InChI Key

QQAMEFIBXXGGLA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08111707

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.652

Distribution Coefficient, logD

4.642

Water Solubility, LogSw

-4.54

Polar Surface Area

47.684

Acid Dissociation Constant (pKa)

9.05

Base Dissociation Constant (pKb)

-2.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

D344-7791 in Drug Discovery

Included in Screening Libraries

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

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with D344-7791 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D344-7791?
Check Price and Availability of D344-7791, 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 D344-7791 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D344-7791
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D344-7791
  • 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 D344-7791 available by request