4896-2944 Screening compound: ethyl 4-(3-ethoxy-2-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

4896-2944 Screening compound: ethyl 4-(3-ethoxy-2-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
4896-2944 Screening compound: ethyl 4-(3-ethoxy-2-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4896-2944
ethyl 4-(3-ethoxy-2-hydroxyphenyl)-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

4896-2944

Molecular Formula

C16H20N2O5 (C16 H20 N2 O5)

Compound Name

ethyl 4-(3-ethoxy-2-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

ethyl 4-(3-ethoxy-2-hydroxyphenyl)-6-methyl-2-oxo-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCOC(C(C(c(cccc1OCC)c1O)N1)=C(C)NC1=O)=O

InChI

InChI=1S/C16H20N2O5/c1-4-22-11-8-6-7-10(14(11)19)13-12(15(20)23-5-2)9(3)17-16(21)18-13/h6-8,13,19H,4-5H2,1-3H3,(H2,17,18,21)/t13-/m1/s1

InChI Key

LQFBQQMRNINMBD-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD01647924

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.824

Distribution Coefficient, logD

1.673

Water Solubility, LogSw

-2.16

Polar Surface Area

79.135

Acid Dissociation Constant (pKa)

7.78

Base Dissociation Constant (pKb)

-4.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

4896-2944 in Drug Discovery

Included in Screening Libraries

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 4896-2944 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4896-2944?
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What is the minimum amount of 4896-2944 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4896-2944
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4896-2944
  • 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 4896-2944 available by request