F235-1379 Screening compound: 2-{[5-CYANO-3,3-DIMETHYL-8-(MORPHOLIN-4-YL)-1H,3H,4H-PYRANO[3,4-C]PYRIDIN-6-YL]SULFANYL}-2-PHENYLACETIC ACID

F235-1379 Screening compound: 2-{[5-CYANO-3,3-DIMETHYL-8-(MORPHOLIN-4-YL)-1H,3H,4H-PYRANO[3,4-C]PYRIDIN-6-YL]SULFANYL}-2-PHENYLACETIC ACID
F235-1379 Screening compound: 2-{[5-CYANO-3,3-DIMETHYL-8-(MORPHOLIN-4-YL)-1H,3H,4H-PYRANO[3,4-C]PYRIDIN-6-YL]SULFANYL}-2-PHENYLACETIC ACID alternative view

Chemical Structure Depiction of ChemDiv screening compound F235-1379
2-{[5-CYANO-3,3-DIMETHYL-8-(MORPHOLIN-4-YL)-1H,3H,4H-PYRANO[3,4-C]PYRIDIN-6-YL]SULFANYL}-2-PHENYLACETIC ACID

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

F235-1379

Molecular Formula

C23H25N3O4S (C23 H25 N3 O4 S)

Compound Name

2-{[5-CYANO-3,3-DIMETHYL-8-(MORPHOLIN-4-YL)-1H,3H,4H-PYRANO[3,4-C]PYRIDIN-6-YL]SULFANYL}-2-PHENYLACETIC ACID

IUPAC name

n/a

SMILES

CC(C)(Cc1c2C#N)OCc1c(N1CCOCC1)nc2SC(C(O)=O)c1ccccc1

InChI

InChI=1S/C23H25N3O4S/c1-23(2)12-16-17(13-24)21(31-19(22(27)28)15-6-4-3-5-7-15)25-20(18(16)14-30-23)26-8-10-29-11-9-26/h3-7,19H,8-12,14H2,1-2H3,(H,27,28)/t19-/m1/s1

InChI Key

FFHPYSKSADXQGG-LJQANCHMSA-N

MDL Number (MFCD)

MFCD02997996

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.056

Distribution Coefficient, logD

0.603

Water Solubility, LogSw

-4.28

Polar Surface Area

73.090

Acid Dissociation Constant (pKa)

3.95

Base Dissociation Constant (pKb)

0.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.50

F235-1379 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F235-1379 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F235-1379?
Check Price and Availability of F235-1379, 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 F235-1379 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F235-1379
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F235-1379
  • 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 F235-1379 available by request