L775-0446 Screening compound: ethyl 3-[(3-{[(4-chlorophenyl)methoxy]methyl}-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carbonyl)amino]benzoate

L775-0446 Screening compound: ethyl 3-[(3-{[(4-chlorophenyl)methoxy]methyl}-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carbonyl)amino]benzoate
L775-0446 Screening compound: ethyl 3-[(3-{[(4-chlorophenyl)methoxy]methyl}-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carbonyl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound L775-0446
ethyl 3-[(3-{[(4-chlorophenyl)methoxy]methyl}-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carbonyl)amino]benzoate

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

L775-0446

Molecular Formula

C25H27ClN4O4 (C25 H27 ClN4 O4)

Compound Name

ethyl 3-[(3-{[(4-chlorophenyl)methoxy]methyl}-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carbonyl)amino]benzoate

IUPAC name

ethyl 3-[(3-{[(4-chlorophenyl)methoxy]methyl}-1-methyl-1H4H5H6H7H-pyrazolo[43-c]pyridine-5-carbonyl)amino]benzoate

SMILES

CCOC(c1cccc(NC(N(CC2)Cc3c2n(C)nc3COCc(cc2)ccc2Cl)=O)c1)=O

InChI

InChI=1S/C25H27ClN4O4/c1-3-34-24(31)18-5-4-6-20(13-18)27-25(32)30-12-11-23-21(14-30)22(28-29(23)2)16-33-15-17-7-9-19(26)10-8-17/h4-10,13H,3,11-12,14-16H2,1-2H3,(H,27,32)

InChI Key

DECSGPJLYQKGGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27474310

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.97

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.240

Distribution Coefficient, logD

4.240

Water Solubility, LogSw

-4.62

Polar Surface Area

69.799

Acid Dissociation Constant (pKa)

13.49

Base Dissociation Constant (pKb)

0.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

L775-0446 in Drug Discovery

Included in Screening Libraries

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

Cysteine Proteases Inhibitors Library (7839 compounds)

Eccentric PPI Library (11937 compounds)

Hsp90-Targeted Library (11355 compounds)

Protein-Protein Interaction Library (218420 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
Targets:
  • Proteases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L775-0446 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L775-0446?
Check Price and Availability of L775-0446, 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 L775-0446 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L775-0446
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L775-0446
  • 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 L775-0446 available by request