8014-9254 Screening compound: 2-{[4-methoxy-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]oxy}acetonitrile

8014-9254 Screening compound: 2-{[4-methoxy-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]oxy}acetonitrile
8014-9254 Screening compound: 2-{[4-methoxy-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]oxy}acetonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-9254
2-{[4-methoxy-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]oxy}acetonitrile

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

8014-9254

Molecular Formula

C10H13N5O2 (C10 H13 N5 O2)

Compound Name

2-{[4-methoxy-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]oxy}acetonitrile

IUPAC name

2-{[4-methoxy-6-(pyrrolidin-1-yl)-135-triazin-2-yl]oxy}acetonitrile

SMILES

COc1nc(N2CCCC2)nc(OCC#N)n1

InChI

InChI=1S/C10H13N5O2/c1-16-9-12-8(15-5-2-3-6-15)13-10(14-9)17-7-4-11/h2-3,5-7H2,1H3

InChI Key

NENQWQVJJPYYHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03820990

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

235.25

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.950

Distribution Coefficient, logD

1.950

Water Solubility, LogSw

-1.94

Polar Surface Area

64.905

Acid Dissociation Constant (pKa)

16.10

Base Dissociation Constant (pKb)

-1.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

8014-9254 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8014-9254 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-9254?
Check Price and Availability of 8014-9254, 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 8014-9254 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-9254
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-9254
  • 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 8014-9254 available by request