S397-0124 Screening compound: 4-(methoxymethyl)-1-{1-methyl-1H,4H,6H,7H-pyrano[4,3-c]pyrazole-3-carbonyl}piperidine

S397-0124 Screening compound: 4-(methoxymethyl)-1-{1-methyl-1H,4H,6H,7H-pyrano[4,3-c]pyrazole-3-carbonyl}piperidine
S397-0124 Screening compound: 4-(methoxymethyl)-1-{1-methyl-1H,4H,6H,7H-pyrano[4,3-c]pyrazole-3-carbonyl}piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound S397-0124
4-(methoxymethyl)-1-{1-methyl-1H,4H,6H,7H-pyrano[4,3-c]pyrazole-3-carbonyl}piperidine

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

S397-0124

Molecular Formula

C15H23N3O3 (C15 H23 N3 O3)

Compound Name

4-(methoxymethyl)-1-{1-methyl-1H,4H,6H,7H-pyrano[4,3-c]pyrazole-3-carbonyl}piperidine

IUPAC name

4-(methoxymethyl)-1-{1-methyl-1H4H6H7H-pyrano[43-c]pyrazole-3-carbonyl}piperidine

SMILES

Cn1nc(C(N2CCC(COC)CC2)=O)c2c1CCOC2

InChI

InChI=1S/C15H23N3O3/c1-17-13-5-8-21-10-12(13)14(16-17)15(19)18-6-3-11(4-7-18)9-20-2/h11H,3-10H2,1-2H3

InChI Key

XXGGNSREZZTZFV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32224422

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

293.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.383

Distribution Coefficient, logD

0.383

Water Solubility, LogSw

-0.39

Polar Surface Area

48.655

Acid Dissociation Constant (pKa)

21.75

Base Dissociation Constant (pKb)

-1.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

73.33

References: we are preparing a list of scientific research reports with S397-0124 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S397-0124?
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What is the minimum amount of S397-0124 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S397-0124
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S397-0124
  • 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 S397-0124 available by request