G657-0297 Screening compound: N~3~-(4-fluorobenzyl)-4-methyl-9-oxo-4,5,6,7,8,9-hexahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-3-carboxamide

G657-0297 Screening compound: N~3~-(4-fluorobenzyl)-4-methyl-9-oxo-4,5,6,7,8,9-hexahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidine-3-carboxamide
G657-0297 Screening compound: N~3~-(4-fluorobenzyl)-4-methyl-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 G657-0297
N~3~-(4-fluorobenzyl)-4-methyl-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

G657-0297

Molecular Formula

C18H18FN5O2 (C18 H18 FN5 O2)

Compound Name

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

IUPAC name

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

SMILES

CN(c(n1nc2)c2C(NCc(cc2)ccc2F)=O)C(CCNC2)=C2C1=O

InChI

InChI=1S/C18H18FN5O2/c1-23-15-6-7-20-9-13(15)18(26)24-17(23)14(10-22-24)16(25)21-8-11-2-4-12(19)5-3-11/h2-5,10,20H,6-9H2,1H3,(H,21,25)

InChI Key

NAMYSDGTGXBJFF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27150051

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

355.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.926

Distribution Coefficient, logD

0.851

Water Solubility, LogSw

-2.13

Polar Surface Area

65.015

Acid Dissociation Constant (pKa)

11.21

Base Dissociation Constant (pKb)

6.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

G657-0297 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 G657-0297 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G657-0297?
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What is the minimum amount of G657-0297 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G657-0297
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G657-0297
  • 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 G657-0297 available by request