1140-0156 Screening compound: N-[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]-2-iodobenzamide

1140-0156 Screening compound: N-[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]-2-iodobenzamide
1140-0156 Screening compound: N-[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]-2-iodobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1140-0156
N-[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]-2-iodobenzamide

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

1140-0156

Molecular Formula

C22H17IN2O2 (C22 H17 IN2 O2)

Compound Name

N-[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]-2-iodobenzamide

IUPAC name

N-[2-(4-ethylphenyl)-13-benzoxazol-5-yl]-2-iodobenzamide

SMILES

CCc(cc1)ccc1-c1nc(cc(cc2)NC(c(cccc3)c3I)=O)c2o1

InChI

InChI=1S/C22H17IN2O2/c1-2-14-7-9-15(10-8-14)22-25-19-13-16(11-12-20(19)27-22)24-21(26)17-5-3-4-6-18(17)23/h3-13H,2H2,1H3,(H,24,26)

InChI Key

MKDIWKLSXLUXBP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00811680

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.876

Distribution Coefficient, logD

5.866

Water Solubility, LogSw

-5.48

Polar Surface Area

40.140

Acid Dissociation Constant (pKa)

9.01

Base Dissociation Constant (pKb)

-1.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

1140-0156 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1140-0156 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1140-0156?
Check Price and Availability of 1140-0156, 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 1140-0156 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1140-0156
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1140-0156
  • 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 1140-0156 available by request