C301-4649 Screening compound: N-[4-({2-ethyl-7-hydroxy-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}sulfamoyl)phenyl]acetamide

C301-4649 Screening compound: N-[4-({2-ethyl-7-hydroxy-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}sulfamoyl)phenyl]acetamide
C301-4649 Screening compound: N-[4-({2-ethyl-7-hydroxy-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}sulfamoyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-4649
N-[4-({2-ethyl-7-hydroxy-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}sulfamoyl)phenyl]acetamide

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

C301-4649

Molecular Formula

C16H18N6O4S (C16 H18 N6 O4 S)

Compound Name

N-[4-({2-ethyl-7-hydroxy-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}sulfamoyl)phenyl]acetamide

IUPAC name

N-[4-({2-ethyl-7-hydroxy-5-methyl-[124]triazolo[15-a]pyrimidin-6-yl}sulfamoyl)phenyl]acetamide

SMILES

CCc(nc1nc2C)nn1c(O)c2NS(c(cc1)ccc1NC(C)=O)(=O)=O

InChI

InChI=1S/C16H18N6O4S/c1-4-13-19-16-17-9(2)14(15(24)22(16)20-13)21-27(25,26)12-7-5-11(6-8-12)18-10(3)23/h5-8,21,24H,4H2,1-3H3,(H,18,23)

InChI Key

YBEMBAAYKRJNSJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14743659

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.42

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.096

Distribution Coefficient, logD

-1.739

Water Solubility, LogSw

-2.35

Polar Surface Area

110.314

Acid Dissociation Constant (pKa)

5.57

Base Dissociation Constant (pKb)

3.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

C301-4649 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 C301-4649 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-4649?
Check Price and Availability of C301-4649, 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 C301-4649 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-4649
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-4649
  • 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 C301-4649 available by request