G700-0463 Screening compound: 3-{[4-(5-chloro-2-methylphenyl)piperazino]carbonyl}-4-ethyl-7-(4-methoxybenzyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(4H)-one

G700-0463 Screening compound: 3-{[4-(5-chloro-2-methylphenyl)piperazino]carbonyl}-4-ethyl-7-(4-methoxybenzyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(4H)-one
G700-0463 Screening compound: 3-{[4-(5-chloro-2-methylphenyl)piperazino]carbonyl}-4-ethyl-7-(4-methoxybenzyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(4H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G700-0463
3-{[4-(5-chloro-2-methylphenyl)piperazino]carbonyl}-4-ethyl-7-(4-methoxybenzyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(4H)-one

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

G700-0463

Molecular Formula

C31H35ClN6O3 (C31 H35 ClN6 O3)

Compound Name

3-{[4-(5-chloro-2-methylphenyl)piperazino]carbonyl}-4-ethyl-7-(4-methoxybenzyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(4H)-one

IUPAC name

4-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-2-ethyl-11-[(4-methoxyphenyl)methyl]-26711-tetraazatricyclo[7.4.0.0^{37}]trideca-1(9)35-trien-8-one

SMILES

CCN(c(n1nc2)c2C(N(CC2)CCN2c2c(C)ccc(Cl)c2)=O)C(CCN(Cc(cc2)ccc2OC)C2)=C2C1=O

InChI

InChI=1S/C31H35ClN6O3/c1-4-37-27-11-12-34(19-22-6-9-24(41-3)10-7-22)20-26(27)31(40)38-29(37)25(18-33-38)30(39)36-15-13-35(14-16-36)28-17-23(32)8-5-21(28)2/h5-10,17-18H,4,11-16,19-20H2,1-3H3

InChI Key

XAJIIJVKIMMZRG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27151790

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

575.11

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.699

Distribution Coefficient, logD

4.695

Water Solubility, LogSw

-4.70

Polar Surface Area

59.294

Acid Dissociation Constant (pKa)

27.50

Base Dissociation Constant (pKb)

5.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.70

G700-0463 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with G700-0463 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G700-0463?
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What is the minimum amount of G700-0463 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G700-0463
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G700-0463
  • 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 G700-0463 available by request