G808-0123 Screening compound: N-[5-chloro-2-({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]-3-phenylpropanamide

G808-0123 Screening compound: N-[5-chloro-2-({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]-3-phenylpropanamide
G808-0123 Screening compound: N-[5-chloro-2-({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]-3-phenylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G808-0123
N-[5-chloro-2-({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]-3-phenylpropanamide

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

G808-0123

Molecular Formula

C22H18ClN3O3S (C22 H18 ClN3 O3 S)

Compound Name

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

IUPAC name

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

SMILES

O=C(CCc1ccccc1)Nc(cc(cc1)Cl)c1OCC(N=C1SC=CN11)=CC1=O

InChI

InChI=1S/C22H18ClN3O3S/c23-16-7-8-19(29-14-17-13-21(28)26-10-11-30-22(26)24-17)18(12-16)25-20(27)9-6-15-4-2-1-3-5-15/h1-5,7-8,10-13H,6,9,14H2,(H,25,27)

InChI Key

YHCDDOGHCZCSAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27162199

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.92

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.235

Distribution Coefficient, logD

3.217

Water Solubility, LogSw

-3.59

Polar Surface Area

55.688

Acid Dissociation Constant (pKa)

8.78

Base Dissociation Constant (pKb)

-2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

G808-0123 in Drug Discovery

Included in Screening Libraries

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

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with G808-0123 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G808-0123?
Check Price and Availability of G808-0123, 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 G808-0123 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G808-0123
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G808-0123
  • 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 G808-0123 available by request