4528-1602 Screening compound: 3-methoxy-N-[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]naphthalene-2-carboxamide

4528-1602 Screening compound: 3-methoxy-N-[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]naphthalene-2-carboxamide
4528-1602 Screening compound: 3-methoxy-N-[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]naphthalene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4528-1602
3-methoxy-N-[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]naphthalene-2-carboxamide

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

4528-1602

Molecular Formula

C24H17N3O3 (C24 H17 N3 O3)

Compound Name

3-methoxy-N-[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]naphthalene-2-carboxamide

IUPAC name

3-methoxy-N-[2-(pyridin-4-yl)-13-benzoxazol-5-yl]naphthalene-2-carboxamide

SMILES

COc1cc2ccccc2cc1C(Nc(cc1)cc2c1oc(-c1ccncc1)n2)=O

InChI

InChI=1S/C24H17N3O3/c1-29-22-13-17-5-3-2-4-16(17)12-19(22)23(28)26-18-6-7-21-20(14-18)27-24(30-21)15-8-10-25-11-9-15/h2-14H,1H3,(H,26,28)

InChI Key

UZOYOLKMFORIAZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02994390

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.799

Distribution Coefficient, logD

4.782

Water Solubility, LogSw

-5.16

Polar Surface Area

56.927

Acid Dissociation Constant (pKa)

8.81

Base Dissociation Constant (pKb)

4.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.20

4528-1602 in Drug Discovery

Included in Screening Libraries

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

Cardiovascular Library (22201 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 4528-1602 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4528-1602?
Check Price and Availability of 4528-1602, 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 4528-1602 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4528-1602
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4528-1602
  • 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 4528-1602 available by request