E755-0172 Screening compound: N-(3,4-dimethylphenyl)-2-(2-{[(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(4-hydroxyphenyl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamide

E755-0172 Screening compound: N-(3,4-dimethylphenyl)-2-(2-{[(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(4-hydroxyphenyl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamide
E755-0172 Screening compound: N-(3,4-dimethylphenyl)-2-(2-{[(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(4-hydroxyphenyl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E755-0172
N-(3,4-dimethylphenyl)-2-(2-{[(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(4-hydroxyphenyl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamide

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

E755-0172

Molecular Formula

C24H23N5O6S (C24 H23 N5 O6 S)

Compound Name

N-(3,4-dimethylphenyl)-2-(2-{[(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(4-hydroxyphenyl)methyl]amino}-4-oxo-4,5-dihydro-1,3-thiazol-5-yl)acetamide

IUPAC name

N-(34-dimethylphenyl)-2-(2-{[(6-hydroxy-24-dioxo-1234-tetrahydropyrimidin-5-yl)(4-hydroxyphenyl)methyl]amino}-4-oxo-45-dihydro-13-thiazol-5-yl)acetamide

SMILES

Cc(cc1)c(C)cc1NC(CC1SC(NC(c(cc2)ccc2O)C(C(NC(N2)=O)=O)=C2O)=NC1=O)=O

InChI

InChI=1S/C24H23N5O6S/c1-11-3-6-14(9-12(11)2)25-17(31)10-16-20(32)29-24(36-16)26-19(13-4-7-15(30)8-5-13)18-21(33)27-23(35)28-22(18)34/h3-9,16,19,30H,10H2,1-2H3,(H,25,31)(H,26,29,32)(H3,27,28,33,34,35)

InChI Key

NUHPTYORIJRQDB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14915972

Chemical and Physical Properties

Saltdata

CH3COOH

Molecular Weight

509.54

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

6.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

1.284

Distribution Coefficient, logD

-3.014

Water Solubility, LogSw

-2.21

Polar Surface Area

137.847

Acid Dissociation Constant (pKa)

3.10

Base Dissociation Constant (pKb)

-0.49

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

20.80

E755-0172 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with E755-0172 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E755-0172?
Check Price and Availability of E755-0172, 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 E755-0172 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E755-0172
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E755-0172
  • 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 E755-0172 available by request