G015-0236 Screening compound: N-[2-(4-chlorophenyl)ethyl]-1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide

G015-0236 Screening compound: N-[2-(4-chlorophenyl)ethyl]-1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
G015-0236 Screening compound: N-[2-(4-chlorophenyl)ethyl]-1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G015-0236
N-[2-(4-chlorophenyl)ethyl]-1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-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

G015-0236

Molecular Formula

C19H20ClN5OS (C19 H20 ClN5 OS)

Compound Name

N-[2-(4-chlorophenyl)ethyl]-1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide

IUPAC name

N-[2-(4-chlorophenyl)ethyl]-1-[5-(pyrrolidin-1-yl)-134-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide

SMILES

O=C(c1cccn1-c1nnc(N2CCCC2)s1)NCCc(cc1)ccc1Cl

InChI

InChI=1S/C19H20ClN5OS/c20-15-7-5-14(6-8-15)9-10-21-17(26)16-4-3-13-25(16)19-23-22-18(27-19)24-11-1-2-12-24/h3-8,13H,1-2,9-12H2,(H,21,26)

InChI Key

KKTKJNJAZGHXRI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14976724

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.92

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.156

Distribution Coefficient, logD

4.156

Water Solubility, LogSw

-4.60

Polar Surface Area

53.494

Acid Dissociation Constant (pKa)

14.54

Base Dissociation Constant (pKb)

-0.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

G015-0236 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

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

GPCR Targeted Library (31838 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G015-0236 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G015-0236?
Check Price and Availability of G015-0236, 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 G015-0236 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G015-0236
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G015-0236
  • 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 G015-0236 available by request