SC55-1157 Screening compound: 6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-[(5-methyl-2-pyridyl)methyl]-2,6-diazaspiro[3.4]octane

SC55-1157 Screening compound: 6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-[(5-methyl-2-pyridyl)methyl]-2,6-diazaspiro[3.4]octane
SC55-1157 Screening compound: 6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-[(5-methyl-2-pyridyl)methyl]-2,6-diazaspiro[3.4]octane alternative view

Chemical Structure Depiction of ChemDiv screening compound SC55-1157
6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-[(5-methyl-2-pyridyl)methyl]-2,6-diazaspiro[3.4]octane

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

SC55-1157

Molecular Formula

C25H30N6 (C25 H30 N6)

Compound Name

6-benzyl-8-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-2-[(5-methyl-2-pyridyl)methyl]-2,6-diazaspiro[3.4]octane

IUPAC name

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

SMILES

Cc1cnc(CN(C2)CC2(CN(Cc2ccccc2)C2)C2c2nc(C3CC3)n[nH]2)cc1

InChI

InChI=1S/C25H30N6/c1-18-7-10-21(26-11-18)13-31-16-25(17-31)15-30(12-19-5-3-2-4-6-19)14-22(25)24-27-23(28-29-24)20-8-9-20/h2-7,10-11,20,22H,8-9,12-17H2,1H3,(H,27,28,29)/t22-/m1/s1

InChI Key

SQLLYBICMDHCLI-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD32258664

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.338

Distribution Coefficient, logD

-0.243

Water Solubility, LogSw

-3.19

Polar Surface Area

51.532

Acid Dissociation Constant (pKa)

8.22

Base Dissociation Constant (pKb)

10.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.00

SC55-1157 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SC55-1157 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC55-1157?
Check Price and Availability of SC55-1157, 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 SC55-1157 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC55-1157
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC55-1157
  • 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 SC55-1157 available by request