S062-1162 Screening compound: 5-(methylsulfonyl)-3-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine

S062-1162 Screening compound: 5-(methylsulfonyl)-3-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
S062-1162 Screening compound: 5-(methylsulfonyl)-3-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound S062-1162
5-(methylsulfonyl)-3-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine

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

S062-1162

Molecular Formula

C13H15N3O2S (C13 H15 N3 O2 S)

Compound Name

5-(methylsulfonyl)-3-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine

IUPAC name

5-methanesulfonyl-3-phenyl-1H4H5H6H7H-pyrazolo[43-c]pyridine

SMILES

CS(N(CC1)Cc2c1[nH]nc2-c1ccccc1)(=O)=O

InChI

InChI=1S/C13H15N3O2S/c1-19(17,18)16-8-7-12-11(9-16)13(15-14-12)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,14,15)

InChI Key

OOGFBJHLDJKOCM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27617409

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

277.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.402

Distribution Coefficient, logD

1.402

Water Solubility, LogSw

-2.25

Polar Surface Area

56.136

Acid Dissociation Constant (pKa)

14.12

Base Dissociation Constant (pKb)

0.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.77

S062-1162 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

Hsp90-Targeted Library (11355 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with S062-1162 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S062-1162?
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What is the minimum amount of S062-1162 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S062-1162
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S062-1162
  • 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 S062-1162 available by request