SC68-1723 Screening compound: 4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-N~2~-phenethyl-2-azaspiro[4.5]decane-2-carboxamide

SC68-1723 Screening compound: 4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-N~2~-phenethyl-2-azaspiro[4.5]decane-2-carboxamide
SC68-1723 Screening compound: 4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-N~2~-phenethyl-2-azaspiro[4.5]decane-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC68-1723
4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-N~2~-phenethyl-2-azaspiro[4.5]decane-2-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

SC68-1723

Molecular Formula

C24H33N5O (C24 H33 N5 O)

Compound Name

4-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-N~2~-phenethyl-2-azaspiro[4.5]decane-2-carboxamide

IUPAC name

4-[4-(cyclopropylmethyl)-4H-124-triazol-3-yl]-N-(2-phenylethyl)-2-azaspiro[4.5]decane-2-carboxamide

SMILES

O=C(NCCc1ccccc1)N(C1)CC2(CCCCC2)C1c1nncn1CC1CC1

InChI

InChI=1S/C24H33N5O/c30-23(25-14-11-19-7-3-1-4-8-19)28-16-21(24(17-28)12-5-2-6-13-24)22-27-26-18-29(22)15-20-9-10-20/h1,3-4,7-8,18,20-21H,2,5-6,9-17H2,(H,25,30)/t21-/m0/s1

InChI Key

RLTKKOODDBCSPC-NRFANRHFSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.271

Distribution Coefficient, logD

3.271

Water Solubility, LogSw

-3.21

Polar Surface Area

51.632

Acid Dissociation Constant (pKa)

15.79

Base Dissociation Constant (pKb)

2.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

62.50

SC68-1723 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 SC68-1723 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC68-1723?
Check Price and Availability of SC68-1723, 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 SC68-1723 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC68-1723
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC68-1723
  • 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 SC68-1723 available by request