SB99-0521 Screening compound: 3-{1-methyl-5-[(2-methyl-3-furyl)carbonyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}-1-(1-pyrrolidinyl)-1-propanone

SB99-0521 Screening compound: 3-{1-methyl-5-[(2-methyl-3-furyl)carbonyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}-1-(1-pyrrolidinyl)-1-propanone
SB99-0521 Screening compound: 3-{1-methyl-5-[(2-methyl-3-furyl)carbonyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}-1-(1-pyrrolidinyl)-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SB99-0521
3-{1-methyl-5-[(2-methyl-3-furyl)carbonyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}-1-(1-pyrrolidinyl)-1-propanone

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

SB99-0521

Molecular Formula

C20H26N4O3 (C20 H26 N4 O3)

Compound Name

3-{1-methyl-5-[(2-methyl-3-furyl)carbonyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}-1-(1-pyrrolidinyl)-1-propanone

IUPAC name

3-[1-methyl-5-(2-methylfuran-3-carbonyl)-1H4H5H6H7H-pyrazolo[43-c]pyridin-3-yl]-1-(pyrrolidin-1-yl)propan-1-one

SMILES

Cc(occ1)c1C(N(CC1)Cc2c1n(C)nc2CCC(N1CCCC1)=O)=O

InChI

InChI=1S/C20H26N4O3/c1-14-15(8-12-27-14)20(26)24-11-7-18-16(13-24)17(21-22(18)2)5-6-19(25)23-9-3-4-10-23/h8,12H,3-7,9-11,13H2,1-2H3

InChI Key

WJCHYCVTDINNQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32252270

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.759

Distribution Coefficient, logD

0.759

Water Solubility, LogSw

-1.90

Polar Surface Area

56.781

Acid Dissociation Constant (pKa)

22.20

Base Dissociation Constant (pKb)

1.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.00

SB99-0521 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SB99-0521 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB99-0521?
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What is the minimum amount of SB99-0521 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB99-0521
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB99-0521
  • 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 SB99-0521 available by request