8289-3917 Screening compound: N-[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]-2-(2,4-dichlorophenoxy)propanamide

8289-3917 Screening compound: N-[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]-2-(2,4-dichlorophenoxy)propanamide
8289-3917 Screening compound: N-[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]-2-(2,4-dichlorophenoxy)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8289-3917
N-[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]-2-(2,4-dichlorophenoxy)propanamide

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

8289-3917

Molecular Formula

C22H15Cl3N2O3 (C22 H15 Cl3 N2 O3)

Compound Name

N-[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]-2-(2,4-dichlorophenoxy)propanamide

IUPAC name

N-[5-(13-benzoxazol-2-yl)-2-chlorophenyl]-2-(24-dichlorophenoxy)propanamide

SMILES

CC(C(Nc(cc(cc1)-c2nc(cccc3)c3o2)c1Cl)=O)Oc(ccc(Cl)c1)c1Cl

InChI

InChI=1S/C22H15Cl3N2O3/c1-12(29-19-9-7-14(23)11-16(19)25)21(28)26-18-10-13(6-8-15(18)24)22-27-17-4-2-3-5-20(17)30-22/h2-12H,1H3,(H,26,28)/t12-/m0/s1

InChI Key

LGWFVZHSUYNHLH-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD04219821

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.73

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.830

Distribution Coefficient, logD

6.830

Water Solubility, LogSw

-6.43

Polar Surface Area

46.318

Acid Dissociation Constant (pKa)

11.19

Base Dissociation Constant (pKb)

-1.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

9.10

References: we are preparing a list of scientific research reports with 8289-3917 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8289-3917?
Check Price and Availability of 8289-3917, 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 8289-3917 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8289-3917
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8289-3917
  • 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 8289-3917 available by request