3729-2763 Screening compound: 2-(4-tert-butylphenoxy)-N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide

3729-2763 Screening compound: 2-(4-tert-butylphenoxy)-N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide
3729-2763 Screening compound: 2-(4-tert-butylphenoxy)-N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3729-2763
2-(4-tert-butylphenoxy)-N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide

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

3729-2763

Molecular Formula

C26H25ClN2O3 (C26 H25 ClN2 O3)

Compound Name

2-(4-tert-butylphenoxy)-N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide

IUPAC name

2-(4-tert-butylphenoxy)-N-[4-chloro-3-(5-methyl-13-benzoxazol-2-yl)phenyl]acetamide

SMILES

CC(C)(C)c(cc1)ccc1OCC(Nc(cc1)cc(-c2nc(cc(C)cc3)c3o2)c1Cl)=O

InChI

InChI=1S/C26H25ClN2O3/c1-16-5-12-23-22(13-16)29-25(32-23)20-14-18(8-11-21(20)27)28-24(30)15-31-19-9-6-17(7-10-19)26(2,3)4/h5-14H,15H2,1-4H3,(H,28,30)

InChI Key

GJGBKNDLIDZEQB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02624806

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.95

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.334

Distribution Coefficient, logD

7.334

Water Solubility, LogSw

-6.39

Polar Surface Area

47.426

Acid Dissociation Constant (pKa)

11.53

Base Dissociation Constant (pKb)

-0.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with 3729-2763 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3729-2763?
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What is the minimum amount of 3729-2763 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3729-2763
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3729-2763
  • 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 3729-2763 available by request