1315-0412 Screening compound: N-[3-(1,3-benzoxazol-2-yl)phenyl]-3-iodobenzamide

1315-0412 Screening compound: N-[3-(1,3-benzoxazol-2-yl)phenyl]-3-iodobenzamide
1315-0412 Screening compound: N-[3-(1,3-benzoxazol-2-yl)phenyl]-3-iodobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1315-0412
N-[3-(1,3-benzoxazol-2-yl)phenyl]-3-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

1315-0412

Molecular Formula

C20H13IN2O2 (C20 H13 IN2 O2)

Compound Name

N-[3-(1,3-benzoxazol-2-yl)phenyl]-3-iodobenzamide

IUPAC name

N-[3-(13-benzoxazol-2-yl)phenyl]-3-iodobenzamide

SMILES

O=C(c1cccc(I)c1)Nc1cc(-c2nc(cccc3)c3o2)ccc1

InChI

InChI=1S/C20H13IN2O2/c21-15-7-3-5-13(11-15)19(24)22-16-8-4-6-14(12-16)20-23-17-9-1-2-10-18(17)25-20/h1-12H,(H,22,24)

InChI Key

GDCVTBJSAYVXFC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00606157

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.24

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.893

Distribution Coefficient, logD

5.893

Water Solubility, LogSw

-5.93

Polar Surface Area

40.140

Acid Dissociation Constant (pKa)

10.97

Base Dissociation Constant (pKb)

-1.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1315-0412 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1315-0412 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1315-0412?
Check Price and Availability of 1315-0412, 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 1315-0412 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1315-0412
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1315-0412
  • 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 1315-0412 available by request