L631-0675 Screening compound: 2-(4-fluorophenyl)-1-(1-methyl-3-{[4-(1-pyrrolidinylcarbonyl)piperidino]carbonyl}-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)-1-ethanone

L631-0675 Screening compound: 2-(4-fluorophenyl)-1-(1-methyl-3-{[4-(1-pyrrolidinylcarbonyl)piperidino]carbonyl}-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)-1-ethanone
L631-0675 Screening compound: 2-(4-fluorophenyl)-1-(1-methyl-3-{[4-(1-pyrrolidinylcarbonyl)piperidino]carbonyl}-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound L631-0675
2-(4-fluorophenyl)-1-(1-methyl-3-{[4-(1-pyrrolidinylcarbonyl)piperidino]carbonyl}-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)-1-ethanone

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

L631-0675

Molecular Formula

C26H32FN5O3 (C26 H32 FN5 O3)

Compound Name

2-(4-fluorophenyl)-1-(1-methyl-3-{[4-(1-pyrrolidinylcarbonyl)piperidino]carbonyl}-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl)-1-ethanone

IUPAC name

2-(4-fluorophenyl)-1-{1-methyl-3-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-1H4H5H6H7H-pyrazolo[43-c]pyridin-5-yl}ethan-1-one

SMILES

Cn1nc(C(N(CC2)CCC2C(N2CCCC2)=O)=O)c(C2)c1CCN2C(Cc(cc1)ccc1F)=O

InChI

InChI=1S/C26H32FN5O3/c1-29-22-10-15-32(23(33)16-18-4-6-20(27)7-5-18)17-21(22)24(28-29)26(35)31-13-8-19(9-14-31)25(34)30-11-2-3-12-30/h4-7,19H,2-3,8-17H2,1H3

InChI Key

HGHBNILDYWSBAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27641891

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.463

Distribution Coefficient, logD

1.463

Water Solubility, LogSw

-1.92

Polar Surface Area

64.702

Acid Dissociation Constant (pKa)

16.90

Base Dissociation Constant (pKb)

3.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.85

L631-0675 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Cysteine Proteases Inhibitors Library (7839 compounds)

Hsp90-Targeted Library (11355 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Proteases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with L631-0675 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L631-0675?
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What is the minimum amount of L631-0675 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L631-0675
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L631-0675
  • 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 L631-0675 available by request