3909-9968 Screening compound: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]isoquinoline

3909-9968 Screening compound: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]isoquinoline
3909-9968 Screening compound: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]isoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 3909-9968
1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]isoquinoline

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

3909-9968

Molecular Formula

C30H32N6O2 (C30 H32 N6 O2)

Compound Name

1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]isoquinoline

IUPAC name

1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]isoquinoline

SMILES

COc(cccc1)c1N(CC1)CCN1c1ncc(C(N(CC2)CCN2c2ncccc2)=O)c2ccccc12

InChI

InChI=1S/C30H32N6O2/c1-38-27-11-5-4-10-26(27)33-14-18-35(19-15-33)29-24-9-3-2-8-23(24)25(22-32-29)30(37)36-20-16-34(17-21-36)28-12-6-7-13-31-28/h2-13,22H,14-21H2,1H3

InChI Key

VZABSBDOSLCGDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14709332

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.62

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.890

Distribution Coefficient, logD

4.881

Water Solubility, LogSw

-4.73

Polar Surface Area

51.500

Acid Dissociation Constant (pKa)

23.67

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

3909-9968 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anticancer Library (62698 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3909-9968 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3909-9968?
Check Price and Availability of 3909-9968, 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 3909-9968 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3909-9968
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3909-9968
  • 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 3909-9968 available by request