SC68-1668 Screening compound: {4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]dec-2-yl}(1-methyl-1H-indazol-3-yl)methanone

SC68-1668 Screening compound: {4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]dec-2-yl}(1-methyl-1H-indazol-3-yl)methanone
SC68-1668 Screening compound: {4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]dec-2-yl}(1-methyl-1H-indazol-3-yl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SC68-1668
{4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]dec-2-yl}(1-methyl-1H-indazol-3-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

SC68-1668

Molecular Formula

C24H30N6O (C24 H30 N6 O)

Compound Name

{4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-2-azaspiro[4.5]dec-2-yl}(1-methyl-1H-indazol-3-yl)methanone

IUPAC name

4-[4-(cyclopropylmethyl)-4H-124-triazol-3-yl]-2-(1-methyl-1H-indazole-3-carbonyl)-2-azaspiro[4.5]decane

SMILES

Cn1nc(C(N(C2)CC3(CCCCC3)C2c2nncn2CC2CC2)=O)c2c1cccc2

InChI

InChI=1S/C24H30N6O/c1-28-20-8-4-3-7-18(20)21(27-28)23(31)29-14-19(24(15-29)11-5-2-6-12-24)22-26-25-16-30(22)13-17-9-10-17/h3-4,7-8,16-17,19H,2,5-6,9-15H2,1H3/t19-/m0/s1

InChI Key

CKNUMLXJEDDPDI-IBGZPJMESA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.569

Distribution Coefficient, logD

2.569

Water Solubility, LogSw

-2.53

Polar Surface Area

56.184

Acid Dissociation Constant (pKa)

21.66

Base Dissociation Constant (pKb)

1.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

58.33

SC68-1668 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with SC68-1668 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC68-1668?
Check Price and Availability of SC68-1668, 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 SC68-1668 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC68-1668
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC68-1668
  • 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 SC68-1668 available by request