S025-0180 Screening compound: 1-{3'-[(2-methoxyethyl)amino]-1'H-spiro[piperidine-4,2'-pyrido[2,3-b]pyrazin]-1-yl}-2-(2-methylphenoxy)ethan-1-one

S025-0180 Screening compound: 1-{3'-[(2-methoxyethyl)amino]-1'H-spiro[piperidine-4,2'-pyrido[2,3-b]pyrazin]-1-yl}-2-(2-methylphenoxy)ethan-1-one
S025-0180 Screening compound: 1-{3'-[(2-methoxyethyl)amino]-1'H-spiro[piperidine-4,2'-pyrido[2,3-b]pyrazin]-1-yl}-2-(2-methylphenoxy)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S025-0180
1-{3'-[(2-methoxyethyl)amino]-1'H-spiro[piperidine-4,2'-pyrido[2,3-b]pyrazin]-1-yl}-2-(2-methylphenoxy)ethan-1-one

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

S025-0180

Molecular Formula

C23H29N5O3 (C23 H29 N5 O3)

Compound Name

1-{3'-[(2-methoxyethyl)amino]-1'H-spiro[piperidine-4,2'-pyrido[2,3-b]pyrazin]-1-yl}-2-(2-methylphenoxy)ethan-1-one

IUPAC name

1-{3'-[(2-methoxyethyl)amino]-1'H-spiro[piperidine-42'-pyrido[23-b]pyrazin]-1-yl}-2-(2-methylphenoxy)ethan-1-one

SMILES

Cc(cccc1)c1OCC(N(CC1)CCC11Nc(cccn2)c2N=C1NCCOC)=O

InChI

InChI=1S/C23H29N5O3/c1-17-6-3-4-8-19(17)31-16-20(29)28-13-9-23(10-14-28)22(25-12-15-30-2)26-21-18(27-23)7-5-11-24-21/h3-8,11,27H,9-10,12-16H2,1-2H3,(H,24,25,26)

InChI Key

KWYJOJYWXBDPKV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27616813

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.850

Distribution Coefficient, logD

0.555

Water Solubility, LogSw

-1.99

Polar Surface Area

73.822

Acid Dissociation Constant (pKa)

15.46

Base Dissociation Constant (pKb)

8.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.48

References: we are preparing a list of scientific research reports with S025-0180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S025-0180?
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What is the minimum amount of S025-0180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S025-0180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S025-0180
  • 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 S025-0180 available by request