SC70-0659 Screening compound: [3-(4-fluorophenyl)-1H-pyrazol-4-yl][8-(5-methyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]oct-6-yl]methanone

SC70-0659 Screening compound: [3-(4-fluorophenyl)-1H-pyrazol-4-yl][8-(5-methyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]oct-6-yl]methanone
SC70-0659 Screening compound: [3-(4-fluorophenyl)-1H-pyrazol-4-yl][8-(5-methyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]oct-6-yl]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SC70-0659
[3-(4-fluorophenyl)-1H-pyrazol-4-yl][8-(5-methyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]oct-6-yl]methanone

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

SC70-0659

Molecular Formula

C20H21FN6O (C20 H21 FN6 O)

Compound Name

[3-(4-fluorophenyl)-1H-pyrazol-4-yl][8-(5-methyl-1H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]oct-6-yl]methanone

IUPAC name

6-[3-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]-8-(5-methyl-1H-124-triazol-3-yl)-6-azaspiro[3.4]octane

SMILES

Cc1nc(C(C2)C3(CCC3)CN2C(c2c[nH]nc2-c(cc2)ccc2F)=O)n[nH]1

InChI

InChI=1S/C20H21FN6O/c1-12-23-18(26-24-12)16-10-27(11-20(16)7-2-8-20)19(28)15-9-22-25-17(15)13-3-5-14(21)6-4-13/h3-6,9,16H,2,7-8,10-11H2,1H3,(H,22,25)(H,23,24,26)/t16-/m0/s1

InChI Key

GGFXYLXBXLGICQ-INIZCTEOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.176

Distribution Coefficient, logD

2.174

Water Solubility, LogSw

-2.91

Polar Surface Area

74.959

Acid Dissociation Constant (pKa)

9.72

Base Dissociation Constant (pKb)

3.08

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

SC70-0659 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with SC70-0659 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC70-0659?
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What is the minimum amount of SC70-0659 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC70-0659
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC70-0659
  • 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 SC70-0659 available by request