G639-0701 Screening compound: N-[2-(3-methylthiophen-2-yl)ethyl]-5-(pyridin-3-yl)-1H-pyrazole-3-carboxamide

G639-0701 Screening compound: N-[2-(3-methylthiophen-2-yl)ethyl]-5-(pyridin-3-yl)-1H-pyrazole-3-carboxamide
G639-0701 Screening compound: N-[2-(3-methylthiophen-2-yl)ethyl]-5-(pyridin-3-yl)-1H-pyrazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G639-0701
N-[2-(3-methylthiophen-2-yl)ethyl]-5-(pyridin-3-yl)-1H-pyrazole-3-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

G639-0701

Molecular Formula

C16H16N4OS (C16 H16 N4 OS)

Compound Name

N-[2-(3-methylthiophen-2-yl)ethyl]-5-(pyridin-3-yl)-1H-pyrazole-3-carboxamide

IUPAC name

N-[2-(3-methylthiophen-2-yl)ethyl]-5-(pyridin-3-yl)-1H-pyrazole-3-carboxamide

SMILES

Cc1c(CCNC(c2n[nH]c(-c3cnccc3)c2)=O)scc1

InChI

InChI=1S/C16H16N4OS/c1-11-5-8-22-15(11)4-7-18-16(21)14-9-13(19-20-14)12-3-2-6-17-10-12/h2-3,5-6,8-10H,4,7H2,1H3,(H,18,21)(H,19,20)

InChI Key

GMZMOQYGVSWCJS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27147431

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.4

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

2.412

Distribution Coefficient, logD

2.412

Water Solubility, LogSw

-2.27

Polar Surface Area

57.519

Acid Dissociation Constant (pKa)

11.46

Base Dissociation Constant (pKb)

3.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

G639-0701 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G639-0701 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G639-0701?
Check Price and Availability of G639-0701, 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 G639-0701 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G639-0701
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G639-0701
  • 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 G639-0701 available by request