SB99-0401 Screening compound: N-cyclopropyl-3-{5-[2-(4-ethoxyphenyl)acetyl]-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}propanamide

SB99-0401 Screening compound: N-cyclopropyl-3-{5-[2-(4-ethoxyphenyl)acetyl]-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}propanamide
SB99-0401 Screening compound: N-cyclopropyl-3-{5-[2-(4-ethoxyphenyl)acetyl]-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB99-0401
N-cyclopropyl-3-{5-[2-(4-ethoxyphenyl)acetyl]-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}propanamide

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

SB99-0401

Molecular Formula

C23H30N4O3 (C23 H30 N4 O3)

Compound Name

N-cyclopropyl-3-{5-[2-(4-ethoxyphenyl)acetyl]-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}propanamide

IUPAC name

N-cyclopropyl-3-{5-[2-(4-ethoxyphenyl)acetyl]-1-methyl-1H4H5H6H7H-pyrazolo[43-c]pyridin-3-yl}propanamide

SMILES

CCOc1ccc(CC(N(CC2)Cc3c2n(C)nc3CCC(NC2CC2)=O)=O)cc1

InChI

InChI=1S/C23H30N4O3/c1-3-30-18-8-4-16(5-9-18)14-23(29)27-13-12-21-19(15-27)20(25-26(21)2)10-11-22(28)24-17-6-7-17/h4-5,8-9,17H,3,6-7,10-15H2,1-2H3,(H,24,28)

InChI Key

HMZUIWHPFUSYDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32251306

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.596

Distribution Coefficient, logD

1.596

Water Solubility, LogSw

-2.26

Polar Surface Area

62.914

Acid Dissociation Constant (pKa)

13.51

Base Dissociation Constant (pKb)

2.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.17

SB99-0401 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SB99-0401 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB99-0401?
Check Price and Availability of SB99-0401, 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 SB99-0401 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB99-0401
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB99-0401
  • 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 SB99-0401 available by request