K808-5181 Screening compound: 3-iodo-4-methyl-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)benzamide

K808-5181 Screening compound: 3-iodo-4-methyl-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)benzamide
K808-5181 Screening compound: 3-iodo-4-methyl-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K808-5181
3-iodo-4-methyl-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)benzamide

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

K808-5181

Molecular Formula

C14H16IN3O (C14 H16 IN3 O)

Compound Name

3-iodo-4-methyl-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)benzamide

IUPAC name

3-iodo-4-methyl-N-(135-trimethyl-1H-pyrazol-4-yl)benzamide

SMILES

Cc(n(C)nc1C)c1NC(c1cc(I)c(C)cc1)=O

InChI

InChI=1S/C14H16IN3O/c1-8-5-6-11(7-12(8)15)14(19)16-13-9(2)17-18(4)10(13)3/h5-7H,1-4H3,(H,16,19)

InChI Key

LMTXIDODCDYAPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15109272

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.21

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.138

Distribution Coefficient, logD

2.043

Water Solubility, LogSw

-2.96

Polar Surface Area

36.773

Acid Dissociation Constant (pKa)

8.02

Base Dissociation Constant (pKb)

-0.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

K808-5181 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with K808-5181 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K808-5181?
Check Price and Availability of K808-5181, 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 K808-5181 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K808-5181
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K808-5181
  • 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 K808-5181 available by request