SA55-0860 Screening compound: 3-methyl-N~1~-[2-(1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)ethyl]butanamide

SA55-0860 Screening compound: 3-methyl-N~1~-[2-(1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)ethyl]butanamide
SA55-0860 Screening compound: 3-methyl-N~1~-[2-(1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)ethyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA55-0860
3-methyl-N~1~-[2-(1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)ethyl]butanamide

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

SA55-0860

Molecular Formula

C14H23N3O2 (C14 H23 N3 O2)

Compound Name

3-methyl-N~1~-[2-(1-methyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)ethyl]butanamide

IUPAC name

3-methyl-N-(2-{1-methyl-1H4H6H7H-pyrano[43-c]pyrazol-3-yl}ethyl)butanamide

SMILES

CC(C)CC(NCCc1nn(C)c2c1COCC2)=O

InChI

InChI=1S/C14H23N3O2/c1-10(2)8-14(18)15-6-4-12-11-9-19-7-5-13(11)17(3)16-12/h10H,4-9H2,1-3H3,(H,15,18)

InChI Key

JVVGMOWORGDBGV-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

265.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.379

Distribution Coefficient, logD

0.379

Water Solubility, LogSw

-1.08

Polar Surface Area

48.392

Acid Dissociation Constant (pKa)

14.52

Base Dissociation Constant (pKb)

1.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

71.43

References: we are preparing a list of scientific research reports with SA55-0860 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA55-0860?
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What is the minimum amount of SA55-0860 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA55-0860
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA55-0860
  • 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 SA55-0860 available by request