F235-1438 Screening compound: 2-({2-[6,7-dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl]-2-oxoethyl}sulfanyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl cyanide

F235-1438 Screening compound: 2-({2-[6,7-dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl]-2-oxoethyl}sulfanyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl cyanide
F235-1438 Screening compound: 2-({2-[6,7-dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl]-2-oxoethyl}sulfanyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound F235-1438
2-({2-[6,7-dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl]-2-oxoethyl}sulfanyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl cyanide

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

F235-1438

Molecular Formula

C22H23N3O3S (C22 H23 N3 O3 S)

Compound Name

2-({2-[6,7-dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl]-2-oxoethyl}sulfanyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl cyanide

IUPAC name

n/a

SMILES

COc1cc(CCN(C2)C(CSc3nc(CCC4)c4cc3C#N)=O)c2cc1OC

InChI

InChI=1S/C22H23N3O3S/c1-27-19-9-14-6-7-25(12-17(14)10-20(19)28-2)21(26)13-29-22-16(11-23)8-15-4-3-5-18(15)24-22/h8-10H,3-7,12-13H2,1-2H3

InChI Key

ZSONPWYIKMWNLF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03234619

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.343

Distribution Coefficient, logD

3.343

Water Solubility, LogSw

-3.57

Polar Surface Area

58.873

Acid Dissociation Constant (pKa)

17.91

Base Dissociation Constant (pKb)

1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

F235-1438 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with F235-1438 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F235-1438?
Check Price and Availability of F235-1438, 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 F235-1438 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F235-1438
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F235-1438
  • 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 F235-1438 available by request