2152-0149 Screening compound: 3-(3-methylbutoxy)-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]benzamide

2152-0149 Screening compound: 3-(3-methylbutoxy)-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]benzamide
2152-0149 Screening compound: 3-(3-methylbutoxy)-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2152-0149
3-(3-methylbutoxy)-N-[2-(2-methylphenyl)-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

2152-0149

Molecular Formula

C26H26N2O3 (C26 H26 N2 O3)

Compound Name

3-(3-methylbutoxy)-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]benzamide

IUPAC name

3-(3-methylbutoxy)-N-[2-(2-methylphenyl)-13-benzoxazol-5-yl]benzamide

SMILES

CC(C)CCOc1cccc(C(Nc(cc2)cc3c2oc(-c2c(C)cccc2)n3)=O)c1

InChI

InChI=1S/C26H26N2O3/c1-17(2)13-14-30-21-9-6-8-19(15-21)25(29)27-20-11-12-24-23(16-20)28-26(31-24)22-10-5-4-7-18(22)3/h4-12,15-17H,13-14H2,1-3H3,(H,27,29)

InChI Key

QKFJSBNJLQCIOG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01532830

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.556

Distribution Coefficient, logD

6.556

Water Solubility, LogSw

-5.69

Polar Surface Area

47.558

Acid Dissociation Constant (pKa)

10.56

Base Dissociation Constant (pKb)

-2.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

2152-0149 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS targets activity set (6557 compounds)

Lipid Metabolism Library (9174 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 2152-0149 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2152-0149?
Check Price and Availability of 2152-0149, 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 2152-0149 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2152-0149
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2152-0149
  • 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 2152-0149 available by request