C734-0636 Screening compound: 2-{1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-[2-(2-methylpiperidin-1-yl)ethyl]acetamide

C734-0636 Screening compound: 2-{1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-[2-(2-methylpiperidin-1-yl)ethyl]acetamide
C734-0636 Screening compound: 2-{1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-[2-(2-methylpiperidin-1-yl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C734-0636
2-{1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-[2-(2-methylpiperidin-1-yl)ethyl]acetamide

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

C734-0636

Molecular Formula

C20H26N4O2 (C20 H26 N4 O2)

Compound Name

2-{1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-[2-(2-methylpiperidin-1-yl)ethyl]acetamide

IUPAC name

2-{1H4H-chromeno[43-c]pyrazol-1-yl}-N-[2-(2-methylpiperidin-1-yl)ethyl]acetamide

SMILES

CC1N(CCNC(Cn2ncc3c2-c(cccc2)c2OC3)=O)CCCC1

InChI

InChI=1S/C20H26N4O2/c1-15-6-4-5-10-23(15)11-9-21-19(25)13-24-20-16(12-22-24)14-26-18-8-3-2-7-17(18)20/h2-3,7-8,12,15H,4-6,9-11,13-14H2,1H3,(H,21,25)/t15-/m0/s1

InChI Key

POBVLAGIXZIADJ-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD14789707

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.400

Distribution Coefficient, logD

-0.357

Water Solubility, LogSw

-2.29

Polar Surface Area

49.653

Acid Dissociation Constant (pKa)

14.01

Base Dissociation Constant (pKb)

9.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

C734-0636 in Drug Discovery

Included in Screening Libraries

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

CNS MPO Library (28609 compounds)

GPCR Targeted Library (31838 compounds)

Immunological Library (6760 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
  • Immune system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C734-0636 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C734-0636?
Check Price and Availability of C734-0636, 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 C734-0636 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C734-0636
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C734-0636
  • 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 C734-0636 available by request