8014-9194 Screening compound: N-[3-(1H-imidazol-1-yl)propyl]-2-iodobenzamide

8014-9194 Screening compound: N-[3-(1H-imidazol-1-yl)propyl]-2-iodobenzamide
8014-9194 Screening compound: N-[3-(1H-imidazol-1-yl)propyl]-2-iodobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-9194
N-[3-(1H-imidazol-1-yl)propyl]-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

8014-9194

Molecular Formula

C13H14IN3O (C13 H14 IN3 O)

Compound Name

N-[3-(1H-imidazol-1-yl)propyl]-2-iodobenzamide

IUPAC name

N-[3-(1H-imidazol-1-yl)propyl]-2-iodobenzamide

SMILES

O=C(c(cccc1)c1I)NCCCn1cncc1

InChI

InChI=1S/C13H14IN3O/c14-12-5-2-1-4-11(12)13(18)16-6-3-8-17-9-7-15-10-17/h1-2,4-5,7,9-10H,3,6,8H2,(H,16,18)

InChI Key

VIHMKSIXINPVJF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03820947

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

355.18

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.631

Distribution Coefficient, logD

1.389

Water Solubility, LogSw

-2.10

Polar Surface Area

37.294

Acid Dissociation Constant (pKa)

12.81

Base Dissociation Constant (pKb)

7.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.08

8014-9194 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Immune system
Targets:
  • Kinases
  • Others

References: we are preparing a list of scientific research reports with 8014-9194 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-9194?
Check Price and Availability of 8014-9194, 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 8014-9194 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-9194
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-9194
  • 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 8014-9194 available by request