C301-4720 Screening compound: N-{7-hydroxy-2,5-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-2,5-dimethoxybenzene-1-sulfonamide

C301-4720 Screening compound: N-{7-hydroxy-2,5-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-2,5-dimethoxybenzene-1-sulfonamide
C301-4720 Screening compound: N-{7-hydroxy-2,5-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-2,5-dimethoxybenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-4720
N-{7-hydroxy-2,5-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-2,5-dimethoxybenzene-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

C301-4720

Molecular Formula

C15H17N5O5S (C15 H17 N5 O5 S)

Compound Name

N-{7-hydroxy-2,5-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-2,5-dimethoxybenzene-1-sulfonamide

IUPAC name

N-{7-hydroxy-25-dimethyl-[124]triazolo[15-a]pyrimidin-6-yl}-25-dimethoxybenzene-1-sulfonamide

SMILES

Cc(nc1nc2C)nn1c(O)c2NS(c(cc(cc1)OC)c1OC)(=O)=O

InChI

InChI=1S/C15H17N5O5S/c1-8-13(14(21)20-15(16-8)17-9(2)18-20)19-26(22,23)12-7-10(24-3)5-6-11(12)25-4/h5-7,19,21H,1-4H3

InChI Key

AAPPHWAXTDNQRS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14743692

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.4

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.091

Distribution Coefficient, logD

-1.744

Water Solubility, LogSw

-2.29

Polar Surface Area

100.849

Acid Dissociation Constant (pKa)

5.57

Base Dissociation Constant (pKb)

3.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

C301-4720 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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 C301-4720 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-4720?
Check Price and Availability of C301-4720, 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 C301-4720 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-4720
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-4720
  • 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 C301-4720 available by request