G713-0529 Screening compound: 5-[3-(1,4'-BIPIPERIDIN-1'-YL)-3-OXOPROPYL]-N-PHENYL-1,3,4-THIADIAZOLE-2-CARBOXAMIDE

G713-0529 Screening compound: 5-[3-(1,4'-BIPIPERIDIN-1'-YL)-3-OXOPROPYL]-N-PHENYL-1,3,4-THIADIAZOLE-2-CARBOXAMIDE
G713-0529 Screening compound: 5-[3-(1,4'-BIPIPERIDIN-1'-YL)-3-OXOPROPYL]-N-PHENYL-1,3,4-THIADIAZOLE-2-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound G713-0529
5-[3-(1,4'-BIPIPERIDIN-1'-YL)-3-OXOPROPYL]-N-PHENYL-1,3,4-THIADIAZOLE-2-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

G713-0529

Molecular Formula

C22H29N5O2S (C22 H29 N5 O2 S)

Compound Name

5-[3-(1,4'-BIPIPERIDIN-1'-YL)-3-OXOPROPYL]-N-PHENYL-1,3,4-THIADIAZOLE-2-CARBOXAMIDE

IUPAC name

n/a

SMILES

O=C(CCc1nnc(C(Nc2ccccc2)=O)s1)N(CC1)CCC1N1CCCCC1

InChI

InChI=1S/C22H29N5O2S/c28-20(27-15-11-18(12-16-27)26-13-5-2-6-14-26)10-9-19-24-25-22(30-19)21(29)23-17-7-3-1-4-8-17/h1,3-4,7-8,18H,2,5-6,9-16H2,(H,23,29)

InChI Key

DHSHXOPODQJYHW-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.367

Distribution Coefficient, logD

-1.189

Water Solubility, LogSw

-2.80

Polar Surface Area

66.543

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

10.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.50

G713-0529 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G713-0529 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G713-0529?
Check Price and Availability of G713-0529, 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 G713-0529 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G713-0529
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G713-0529
  • 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 G713-0529 available by request