G597-2191 Screening compound: N-[(2-chlorophenyl)methyl]-2-{3-ethyl-6-methyl-4-oxo-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-5-yl}acetamide

G597-2191 Screening compound: N-[(2-chlorophenyl)methyl]-2-{3-ethyl-6-methyl-4-oxo-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-5-yl}acetamide
G597-2191 Screening compound: N-[(2-chlorophenyl)methyl]-2-{3-ethyl-6-methyl-4-oxo-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-5-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G597-2191
N-[(2-chlorophenyl)methyl]-2-{3-ethyl-6-methyl-4-oxo-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-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

G597-2191

Molecular Formula

C17H17ClN4O3 (C17 H17 ClN4 O3)

Compound Name

N-[(2-chlorophenyl)methyl]-2-{3-ethyl-6-methyl-4-oxo-4H,5H-[1,2]oxazolo[5,4-d]pyrimidin-5-yl}acetamide

IUPAC name

N-[(2-chlorophenyl)methyl]-2-{3-ethyl-6-methyl-4-oxo-4H5H-[12]oxazolo[54-d]pyrimidin-5-yl}acetamide

SMILES

CCc1noc(N=C(C)N2CC(NCc(cccc3)c3Cl)=O)c1C2=O

InChI

InChI=1S/C17H17ClN4O3/c1-3-13-15-16(25-21-13)20-10(2)22(17(15)24)9-14(23)19-8-11-6-4-5-7-12(11)18/h4-7H,3,8-9H2,1-2H3,(H,19,23)

InChI Key

CPZDYVZPNQUJAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27145640

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.8

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.174

Distribution Coefficient, logD

2.173

Water Solubility, LogSw

-3.22

Polar Surface Area

70.987

Acid Dissociation Constant (pKa)

13.25

Base Dissociation Constant (pKb)

4.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

G597-2191 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

BRD4 Targeted Library (4534 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Agro:
  • Agro
  • Agro
Targets:
  • Others

References: we are preparing a list of scientific research reports with G597-2191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G597-2191?
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What is the minimum amount of G597-2191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G597-2191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G597-2191
  • 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 G597-2191 available by request