G125-0710 Screening compound: 1-{[5-(2-methyl-1H-indol-1-yl)-2-thienyl]carbonyl}-N-(4-methylphenyl)-4-piperidinecarboxamide

G125-0710 Screening compound: 1-{[5-(2-methyl-1H-indol-1-yl)-2-thienyl]carbonyl}-N-(4-methylphenyl)-4-piperidinecarboxamide
G125-0710 Screening compound: 1-{[5-(2-methyl-1H-indol-1-yl)-2-thienyl]carbonyl}-N-(4-methylphenyl)-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G125-0710
1-{[5-(2-methyl-1H-indol-1-yl)-2-thienyl]carbonyl}-N-(4-methylphenyl)-4-piperidinecarboxamide

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

G125-0710

Molecular Formula

C27H27N3O2S (C27 H27 N3 O2 S)

Compound Name

1-{[5-(2-methyl-1H-indol-1-yl)-2-thienyl]carbonyl}-N-(4-methylphenyl)-4-piperidinecarboxamide

IUPAC name

1-[5-(2-methyl-1H-indol-1-yl)thiophene-2-carbonyl]-N-(4-methylphenyl)piperidine-4-carboxamide

SMILES

Cc1cc(cccc2)c2n1-c1ccc(C(N(CC2)CCC2C(Nc2ccc(C)cc2)=O)=O)s1

InChI

InChI=1S/C27H27N3O2S/c1-18-7-9-22(10-8-18)28-26(31)20-13-15-29(16-14-20)27(32)24-11-12-25(33-24)30-19(2)17-21-5-3-4-6-23(21)30/h3-12,17,20H,13-16H2,1-2H3,(H,28,31)

InChI Key

UXUOEVWRTSWHDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14982692

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.6

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.351

Distribution Coefficient, logD

5.351

Water Solubility, LogSw

-6.02

Polar Surface Area

43.516

Acid Dissociation Constant (pKa)

11.95

Base Dissociation Constant (pKb)

1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.93

G125-0710 in Drug Discovery

Included in Screening Libraries

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

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G125-0710 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G125-0710?
Check Price and Availability of G125-0710, 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 G125-0710 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G125-0710
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G125-0710
  • 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 G125-0710 available by request