G606-0202 Screening compound: 2-({5-[1-(3-chloro-4-methoxyphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N-(3-methoxyphenyl)acetamide

G606-0202 Screening compound: 2-({5-[1-(3-chloro-4-methoxyphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N-(3-methoxyphenyl)acetamide
G606-0202 Screening compound: 2-({5-[1-(3-chloro-4-methoxyphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N-(3-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G606-0202
2-({5-[1-(3-chloro-4-methoxyphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N-(3-methoxyphenyl)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

G606-0202

Molecular Formula

C22H21ClN4O5S (C22 H21 ClN4 O5 S)

Compound Name

2-({5-[1-(3-chloro-4-methoxyphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N-(3-methoxyphenyl)acetamide

IUPAC name

2-({5-[1-(3-chloro-4-methoxyphenyl)-5-oxopyrrolidin-3-yl]-134-oxadiazol-2-yl}sulfanyl)-N-(3-methoxyphenyl)acetamide

SMILES

COc1cccc(NC(CSc2nnc(C(CC3=O)CN3c(cc3)cc(Cl)c3OC)o2)=O)c1

InChI

InChI=1S/C22H21ClN4O5S/c1-30-16-5-3-4-14(9-16)24-19(28)12-33-22-26-25-21(32-22)13-8-20(29)27(11-13)15-6-7-18(31-2)17(23)10-15/h3-7,9-10,13H,8,11-12H2,1-2H3,(H,24,28)/t13-/m1/s1

InChI Key

IBIABYYVAILZCT-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD09981014

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.95

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.007

Distribution Coefficient, logD

3.007

Water Solubility, LogSw

-3.50

Polar Surface Area

85.138

Acid Dissociation Constant (pKa)

11.48

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.30

G606-0202 in Drug Discovery

Included in Screening Libraries

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G606-0202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G606-0202?
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What is the minimum amount of G606-0202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G606-0202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G606-0202
  • 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 G606-0202 available by request