F148-0022 Screening compound: 7-benzyl-N~3~-(4-chlorobenzyl)-4-ethyl-9-oxo-4,5,6,7,8,9-hexahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-3-carboxamide

F148-0022 Screening compound: 7-benzyl-N~3~-(4-chlorobenzyl)-4-ethyl-9-oxo-4,5,6,7,8,9-hexahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-3-carboxamide
F148-0022 Screening compound: 7-benzyl-N~3~-(4-chlorobenzyl)-4-ethyl-9-oxo-4,5,6,7,8,9-hexahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F148-0022
7-benzyl-N~3~-(4-chlorobenzyl)-4-ethyl-9-oxo-4,5,6,7,8,9-hexahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-3-carboxamide

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

F148-0022

Molecular Formula

C26H26ClN5O2 (C26 H26 ClN5 O2)

Compound Name

7-benzyl-N~3~-(4-chlorobenzyl)-4-ethyl-9-oxo-4,5,6,7,8,9-hexahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-3-carboxamide

IUPAC name

11-benzyl-N-[(4-chlorophenyl)methyl]-2-ethyl-8-oxo-26711-tetraazatricyclo[7.4.0.0^{37}]trideca-1(9)35-triene-4-carboxamide

SMILES

CCN(c(n1nc2)c2C(NCc(cc2)ccc2Cl)=O)C(CCN(Cc2ccccc2)C2)=C2C1=O

InChI

InChI=1S/C26H26ClN5O2/c1-2-31-23-12-13-30(16-19-6-4-3-5-7-19)17-22(23)26(34)32-25(31)21(15-29-32)24(33)28-14-18-8-10-20(27)11-9-18/h3-11,15H,2,12-14,16-17H2,1H3,(H,28,33)

InChI Key

LNEOTPGINYKMAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27104809

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.98

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.245

Distribution Coefficient, logD

4.238

Water Solubility, LogSw

-4.55

Polar Surface Area

56.556

Acid Dissociation Constant (pKa)

11.21

Base Dissociation Constant (pKb)

5.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

F148-0022 in Drug Discovery

Included in Screening Libraries

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F148-0022 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F148-0022?
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What is the minimum amount of F148-0022 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F148-0022
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F148-0022
  • 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 F148-0022 available by request