8013-2744 Screening compound: methyl 4-(2-chloro-6-fluorophenyl)-1-ethyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

8013-2744 Screening compound: methyl 4-(2-chloro-6-fluorophenyl)-1-ethyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
8013-2744 Screening compound: methyl 4-(2-chloro-6-fluorophenyl)-1-ethyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-2744
methyl 4-(2-chloro-6-fluorophenyl)-1-ethyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

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

8013-2744

Molecular Formula

C15H16ClFN2O3 (C15 H16 ClFN2 O3)

Compound Name

methyl 4-(2-chloro-6-fluorophenyl)-1-ethyl-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

methyl 4-(2-chloro-6-fluorophenyl)-1-ethyl-6-methyl-2-oxo-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCN(C(C)=C(C(c(c(F)ccc1)c1Cl)N1)C(OC)=O)C1=O

InChI

InChI=1S/C15H16ClFN2O3/c1-4-19-8(2)11(14(20)22-3)13(18-15(19)21)12-9(16)6-5-7-10(12)17/h5-7,13H,4H2,1-3H3,(H,18,21)/t13-/m0/s1

InChI Key

JPMAGXZQIGBIOA-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD03632563

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.75

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.607

Distribution Coefficient, logD

2.606

Water Solubility, LogSw

-3.40

Polar Surface Area

48.808

Acid Dissociation Constant (pKa)

10.01

Base Dissociation Constant (pKb)

-4.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

8013-2744 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8013-2744 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-2744?
Check Price and Availability of 8013-2744, 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 8013-2744 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-2744
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-2744
  • 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 8013-2744 available by request