S062-1179 Screening compound: 1H-IMIDAZOL-4-YL (3-PHENYL-1,4,6,7-TETRAHYDRO-5H-PYRAZOLO[4,3-C]PYRIDIN-5-YL) SULFONE

S062-1179 Screening compound: 1H-IMIDAZOL-4-YL (3-PHENYL-1,4,6,7-TETRAHYDRO-5H-PYRAZOLO[4,3-C]PYRIDIN-5-YL) SULFONE
S062-1179 Screening compound: 1H-IMIDAZOL-4-YL (3-PHENYL-1,4,6,7-TETRAHYDRO-5H-PYRAZOLO[4,3-C]PYRIDIN-5-YL) SULFONE alternative view

Chemical Structure Depiction of ChemDiv screening compound S062-1179
1H-IMIDAZOL-4-YL (3-PHENYL-1,4,6,7-TETRAHYDRO-5H-PYRAZOLO[4,3-C]PYRIDIN-5-YL) SULFONE

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

S062-1179

Molecular Formula

C15H15N5O2S (C15 H15 N5 O2 S)

Compound Name

1H-IMIDAZOL-4-YL (3-PHENYL-1,4,6,7-TETRAHYDRO-5H-PYRAZOLO[4,3-C]PYRIDIN-5-YL) SULFONE

IUPAC name

n/a

SMILES

O=S(c1c[nH]cn1)(N(CC1)Cc2c1[nH]nc2-c1ccccc1)=O

InChI

InChI=1S/C15H15N5O2S/c21-23(22,14-8-16-10-17-14)20-7-6-13-12(9-20)15(19-18-13)11-4-2-1-3-5-11/h1-5,8,10H,6-7,9H2,(H,16,17)(H,18,19)

InChI Key

ONSBXBLBCDTAHB-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.330

Distribution Coefficient, logD

1.330

Water Solubility, LogSw

-2.27

Polar Surface Area

77.445

Acid Dissociation Constant (pKa)

9.20

Base Dissociation Constant (pKb)

0.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

S062-1179 in Drug Discovery

Included in Screening Libraries

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

Hsp90-Targeted Library (11355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with S062-1179 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S062-1179?
Check Price and Availability of S062-1179, 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 S062-1179 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S062-1179
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S062-1179
  • 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 S062-1179 available by request