T604-0187 Screening compound: 5-(2-hydroxyethyl)-6-methyl-3-({5-methyl-2-[4-(propan-2-yloxy)phenyl]-1,3-oxazol-4-yl}methyl)-2-phenyl-3,4-dihydropyrimidin-4-one

T604-0187 Screening compound: 5-(2-hydroxyethyl)-6-methyl-3-({5-methyl-2-[4-(propan-2-yloxy)phenyl]-1,3-oxazol-4-yl}methyl)-2-phenyl-3,4-dihydropyrimidin-4-one
T604-0187 Screening compound: 5-(2-hydroxyethyl)-6-methyl-3-({5-methyl-2-[4-(propan-2-yloxy)phenyl]-1,3-oxazol-4-yl}methyl)-2-phenyl-3,4-dihydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T604-0187
5-(2-hydroxyethyl)-6-methyl-3-({5-methyl-2-[4-(propan-2-yloxy)phenyl]-1,3-oxazol-4-yl}methyl)-2-phenyl-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

T604-0187

Molecular Formula

C27H29N3O4 (C27 H29 N3 O4)

Compound Name

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

IUPAC name

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

SMILES

CC(C)Oc(cc1)ccc1-c1nc(CN(C(c2ccccc2)=NC(C)=C2CCO)C2=O)c(C)o1

InChI

InChI=1S/C27H29N3O4/c1-17(2)33-22-12-10-21(11-13-22)26-29-24(19(4)34-26)16-30-25(20-8-6-5-7-9-20)28-18(3)23(14-15-31)27(30)32/h5-13,17,31H,14-16H2,1-4H3

InChI Key

AXGITHZVWXOGTN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28997930

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.623

Distribution Coefficient, logD

3.623

Water Solubility, LogSw

-3.64

Polar Surface Area

66.582

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

4.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

T604-0187 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

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:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Hemic and lymphatic
Agro:
  • Agro
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with T604-0187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T604-0187?
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What is the minimum amount of T604-0187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T604-0187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T604-0187
  • 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 T604-0187 available by request