SC55-1025 Screening compound: 6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-N~2~-(2-fluorophenyl)-2,6-diazaspiro[3.4]octane-2-carboxamide

SC55-1025 Screening compound: 6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-N~2~-(2-fluorophenyl)-2,6-diazaspiro[3.4]octane-2-carboxamide
SC55-1025 Screening compound: 6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-N~2~-(2-fluorophenyl)-2,6-diazaspiro[3.4]octane-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC55-1025
6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-N~2~-(2-fluorophenyl)-2,6-diazaspiro[3.4]octane-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

SC55-1025

Molecular Formula

C25H27FN6O (C25 H27 FN6 O)

Compound Name

6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-N~2~-(2-fluorophenyl)-2,6-diazaspiro[3.4]octane-2-carboxamide

IUPAC name

6-benzyl-8-(3-cyclopropyl-1H-124-triazol-5-yl)-N-(2-fluorophenyl)-26-diazaspiro[3.4]octane-2-carboxamide

SMILES

O=C(Nc(cccc1)c1F)N(C1)CC1(CN(Cc1ccccc1)C1)C1c1nc(C2CC2)n[nH]1

InChI

InChI=1S/C25H27FN6O/c26-20-8-4-5-9-21(20)27-24(33)32-15-25(16-32)14-31(12-17-6-2-1-3-7-17)13-19(25)23-28-22(29-30-23)18-10-11-18/h1-9,18-19H,10-16H2,(H,27,33)(H,28,29,30)/t19-/m1/s1

InChI Key

VHRPKRXEIZRRNM-LJQANCHMSA-N

MDL Number (MFCD)

MFCD32257706

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.761

Distribution Coefficient, logD

-0.164

Water Solubility, LogSw

-4.04

Polar Surface Area

62.938

Acid Dissociation Constant (pKa)

8.22

Base Dissociation Constant (pKb)

10.82

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with SC55-1025 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC55-1025?
Check Price and Availability of SC55-1025, 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 SC55-1025 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC55-1025
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC55-1025
  • 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 SC55-1025 available by request