G769-0976 Screening compound: 7-({benzyl[(4-ethoxyphenyl)methyl]amino}methyl)-3-(4-methoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one

G769-0976 Screening compound: 7-({benzyl[(4-ethoxyphenyl)methyl]amino}methyl)-3-(4-methoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
G769-0976 Screening compound: 7-({benzyl[(4-ethoxyphenyl)methyl]amino}methyl)-3-(4-methoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G769-0976
7-({benzyl[(4-ethoxyphenyl)methyl]amino}methyl)-3-(4-methoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-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

G769-0976

Molecular Formula

C30H29N3O3S (C30 H29 N3 O3 S)

Compound Name

7-({benzyl[(4-ethoxyphenyl)methyl]amino}methyl)-3-(4-methoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one

IUPAC name

7-({benzyl[(4-ethoxyphenyl)methyl]amino}methyl)-3-(4-methoxyphenyl)-5H-[13]thiazolo[32-a]pyrimidin-5-one

SMILES

CCOc1ccc(CN(Cc2ccccc2)CC(N=C2SC=C(c(cc3)ccc3OC)N22)=CC2=O)cc1

InChI

InChI=1S/C30H29N3O3S/c1-3-36-27-13-9-23(10-14-27)19-32(18-22-7-5-4-6-8-22)20-25-17-29(34)33-28(21-37-30(33)31-25)24-11-15-26(35-2)16-12-24/h4-17,21H,3,18-20H2,1-2H3

InChI Key

ZIRVJEGXXYYCGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27157512

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

511.64

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.295

Distribution Coefficient, logD

5.263

Water Solubility, LogSw

-5.26

Polar Surface Area

44.103

Acid Dissociation Constant (pKa)

24.85

Base Dissociation Constant (pKb)

6.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

G769-0976 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G769-0976 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G769-0976?
Check Price and Availability of G769-0976, 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 G769-0976 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G769-0976
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G769-0976
  • 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 G769-0976 available by request