8018-8461 Screening compound: (acetyloxy)(phenyl)(pyrimidin-2-yl)methyl acetate

8018-8461 Screening compound: (acetyloxy)(phenyl)(pyrimidin-2-yl)methyl acetate
8018-8461 Screening compound: (acetyloxy)(phenyl)(pyrimidin-2-yl)methyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-8461
(acetyloxy)(phenyl)(pyrimidin-2-yl)methyl acetate

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

8018-8461

Molecular Formula

C15H14N2O4 (C15 H14 N2 O4)

Compound Name

(acetyloxy)(phenyl)(pyrimidin-2-yl)methyl acetate

IUPAC name

(acetyloxy)(phenyl)(pyrimidin-2-yl)methyl acetate

SMILES

CC(OC(c1ccccc1)(c1ncccn1)OC(C)=O)=O

InChI

InChI=1S/C15H14N2O4/c1-11(18)20-15(21-12(2)19,13-7-4-3-5-8-13)14-16-9-6-10-17-14/h3-10H,1-2H3

InChI Key

CQLGZEBCQYANIT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08445387

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

286.29

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.834

Distribution Coefficient, logD

0.834

Water Solubility, LogSw

-1.12

Polar Surface Area

60.352

Acid Dissociation Constant (pKa)

23.66

Base Dissociation Constant (pKb)

-0.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

8018-8461 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8018-8461 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-8461?
Check Price and Availability of 8018-8461, 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 8018-8461 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-8461
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-8461
  • 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 8018-8461 available by request