G614-0307 Screening compound: 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-({3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl}oxy)ethan-1-one

G614-0307 Screening compound: 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-({3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl}oxy)ethan-1-one
G614-0307 Screening compound: 1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-({3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl}oxy)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G614-0307
1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-({3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl}oxy)ethan-1-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

G614-0307

Molecular Formula

C28H29N5O4 (C28 H29 N5 O4)

Compound Name

1-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-({3,4-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-6-yl}oxy)ethan-1-one

IUPAC name

1-{4-[(2H-13-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-({34-dimethyl-1-phenyl-1H-pyrazolo[34-b]pyridin-6-yl}oxy)ethan-1-one

SMILES

Cc(c(c(C)c1)c2nc1OCC(N1CCN(Cc(cc3)cc4c3OCO4)CC1)=O)nn2-c1ccccc1

InChI

InChI=1S/C28H29N5O4/c1-19-14-25(29-28-27(19)20(2)30-33(28)22-6-4-3-5-7-22)35-17-26(34)32-12-10-31(11-13-32)16-21-8-9-23-24(15-21)37-18-36-23/h3-9,14-15H,10-13,16-18H2,1-2H3

InChI Key

UEOIUNBKYPYMGC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27146657

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.448

Distribution Coefficient, logD

3.149

Water Solubility, LogSw

-3.81

Polar Surface Area

67.811

Acid Dissociation Constant (pKa)

20.68

Base Dissociation Constant (pKb)

7.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.10

G614-0307 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G614-0307 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G614-0307?
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What is the minimum amount of G614-0307 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G614-0307
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G614-0307
  • 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 G614-0307 available by request