G717-1250 Screening compound: N~1~-{2-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]ethyl}-1-cyclopentanecarboxamide

G717-1250 Screening compound: N~1~-{2-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]ethyl}-1-cyclopentanecarboxamide
G717-1250 Screening compound: N~1~-{2-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]ethyl}-1-cyclopentanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G717-1250
N~1~-{2-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]ethyl}-1-cyclopentanecarboxamide

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

G717-1250

Molecular Formula

C17H22N4O (C17 H22 N4 O)

Compound Name

N~1~-{2-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]ethyl}-1-cyclopentanecarboxamide

IUPAC name

N-{2-[5-(4-methylphenyl)-1H-124-triazol-3-yl]ethyl}cyclopentanecarboxamide

SMILES

Cc(cc1)ccc1-c1nc(CCNC(C2CCCC2)=O)n[nH]1

InChI

InChI=1S/C17H22N4O/c1-12-6-8-13(9-7-12)16-19-15(20-21-16)10-11-18-17(22)14-4-2-3-5-14/h6-9,14H,2-5,10-11H2,1H3,(H,18,22)(H,19,20,21)

InChI Key

RZRYAWQKOAXVFJ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.067

Distribution Coefficient, logD

3.055

Water Solubility, LogSw

-3.16

Polar Surface Area

59.827

Acid Dissociation Constant (pKa)

6.33

Base Dissociation Constant (pKb)

2.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.06

G717-1250 in Drug Discovery

Included in Screening Libraries

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

Immunological Library (6760 compounds)

Soluble Diversity Library (15920 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with G717-1250 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G717-1250?
Check Price and Availability of G717-1250, 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 G717-1250 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G717-1250
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G717-1250
  • 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 G717-1250 available by request