P313-0643 Screening compound: 4-acetyl-N-{3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl}benzene-1-sulfonamide

P313-0643 Screening compound: 4-acetyl-N-{3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl}benzene-1-sulfonamide
P313-0643 Screening compound: 4-acetyl-N-{3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl}benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P313-0643
4-acetyl-N-{3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl}benzene-1-sulfonamide

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

P313-0643

Molecular Formula

C18H18N4O3S (C18 H18 N4 O3 S)

Compound Name

4-acetyl-N-{3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl}benzene-1-sulfonamide

IUPAC name

4-acetyl-N-{3-cyclobutyl-[124]triazolo[43-a]pyridin-8-yl}benzene-1-sulfonamide

SMILES

CC(c(cc1)ccc1S(Nc1cccn2c1nnc2C1CCC1)(=O)=O)=O

InChI

InChI=1S/C18H18N4O3S/c1-12(23)13-7-9-15(10-8-13)26(24,25)21-16-6-3-11-22-17(14-4-2-5-14)19-20-18(16)22/h3,6-11,14,21H,2,4-5H2,1H3

InChI Key

LAKOROXPTVBOOM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27571590

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.461

Distribution Coefficient, logD

1.262

Water Solubility, LogSw

-2.50

Polar Surface Area

76.425

Acid Dissociation Constant (pKa)

7.64

Base Dissociation Constant (pKb)

1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

P313-0643 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with P313-0643 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P313-0643?
Check Price and Availability of P313-0643, 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 P313-0643 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P313-0643
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P313-0643
  • 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 P313-0643 available by request