G072-1751 Screening compound: 2-methoxy-N-{2-[({5-oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}benzamide

G072-1751 Screening compound: 2-methoxy-N-{2-[({5-oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}benzamide
G072-1751 Screening compound: 2-methoxy-N-{2-[({5-oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G072-1751
2-methoxy-N-{2-[({5-oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}benzamide

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

G072-1751

Molecular Formula

C27H21N3O3S2 (C27 H21 N3 O3 S2)

Compound Name

2-methoxy-N-{2-[({5-oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}benzamide

IUPAC name

2-methoxy-N-{2-[({5-oxo-3-phenyl-5H-[13]thiazolo[32-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}benzamide

SMILES

COc(cccc1)c1C(Nc(cccc1)c1SCC(N=C1SC=C(c2ccccc2)N11)=CC1=O)=O

InChI

InChI=1S/C27H21N3O3S2/c1-33-23-13-7-5-11-20(23)26(32)29-21-12-6-8-14-24(21)34-16-19-15-25(31)30-22(17-35-27(30)28-19)18-9-3-2-4-10-18/h2-15,17H,16H2,1H3,(H,29,32)

InChI Key

PXZPRJNENMARJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14980236

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.61

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.611

Distribution Coefficient, logD

4.609

Water Solubility, LogSw

-4.55

Polar Surface Area

55.748

Acid Dissociation Constant (pKa)

9.64

Base Dissociation Constant (pKb)

-0.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.40

G072-1751 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G072-1751 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G072-1751?
Check Price and Availability of G072-1751, 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 G072-1751 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G072-1751
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G072-1751
  • 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 G072-1751 available by request