T604-0589 Screening compound: 2-(3-chlorophenyl)-5-(2-hydroxyethyl)-6-methyl-3-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}-3,4-dihydropyrimidin-4-one

T604-0589 Screening compound: 2-(3-chlorophenyl)-5-(2-hydroxyethyl)-6-methyl-3-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}-3,4-dihydropyrimidin-4-one
T604-0589 Screening compound: 2-(3-chlorophenyl)-5-(2-hydroxyethyl)-6-methyl-3-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}-3,4-dihydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T604-0589
2-(3-chlorophenyl)-5-(2-hydroxyethyl)-6-methyl-3-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}-3,4-dihydropyrimidin-4-one

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

T604-0589

Molecular Formula

C25H24ClN3O3 (C25 H24 ClN3 O3)

Compound Name

2-(3-chlorophenyl)-5-(2-hydroxyethyl)-6-methyl-3-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}-3,4-dihydropyrimidin-4-one

IUPAC name

2-(3-chlorophenyl)-5-(2-hydroxyethyl)-6-methyl-3-{[5-methyl-2-(3-methylphenyl)-13-oxazol-4-yl]methyl}-34-dihydropyrimidin-4-one

SMILES

Cc1c(CN(C(c2cccc(Cl)c2)=NC(C)=C2CCO)C2=O)nc(-c2cc(C)ccc2)o1

InChI

InChI=1S/C25H24ClN3O3/c1-15-6-4-8-19(12-15)24-28-22(17(3)32-24)14-29-23(18-7-5-9-20(26)13-18)27-16(2)21(10-11-30)25(29)31/h4-9,12-13,30H,10-11,14H2,1-3H3

InChI Key

QBDZFGMUSSCWIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28998004

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.94

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.990

Distribution Coefficient, logD

3.989

Water Solubility, LogSw

-4.26

Polar Surface Area

59.779

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

4.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

T604-0589 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

Bromodomain Modulators Library (5801 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with T604-0589 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T604-0589?
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What is the minimum amount of T604-0589 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T604-0589
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T604-0589
  • 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 T604-0589 available by request