G896-0045 Screening compound: N-[(3-chlorophenyl)methyl]-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

G896-0045 Screening compound: N-[(3-chlorophenyl)methyl]-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
G896-0045 Screening compound: N-[(3-chlorophenyl)methyl]-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G896-0045
N-[(3-chlorophenyl)methyl]-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

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

G896-0045

Molecular Formula

C14H10ClN3O2S (C14 H10 ClN3 O2 S)

Compound Name

N-[(3-chlorophenyl)methyl]-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

IUPAC name

N-[(3-chlorophenyl)methyl]-5-oxo-5H-[13]thiazolo[32-a]pyrimidine-6-carboxamide

SMILES

O=C(C1=CN=C2SC=CN2C1=O)NCc1cccc(Cl)c1

InChI

InChI=1S/C14H10ClN3O2S/c15-10-3-1-2-9(6-10)7-16-12(19)11-8-17-14-18(13(11)20)4-5-21-14/h1-6,8H,7H2,(H,16,19)

InChI Key

BCQHPSGMEZZMEL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15074171

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.77

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.396

Distribution Coefficient, logD

1.202

Water Solubility, LogSw

-2.70

Polar Surface Area

49.855

Acid Dissociation Constant (pKa)

7.65

Base Dissociation Constant (pKb)

-1.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

G896-0045 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G896-0045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G896-0045?
Check Price and Availability of G896-0045, 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 G896-0045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G896-0045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G896-0045
  • 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 G896-0045 available by request