L438-0286 Screening compound: methyl 2-({[8-fluoro-2-(morpholin-4-yl)quinolin-6-yl]carbamoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

L438-0286 Screening compound: methyl 2-({[8-fluoro-2-(morpholin-4-yl)quinolin-6-yl]carbamoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
L438-0286 Screening compound: methyl 2-({[8-fluoro-2-(morpholin-4-yl)quinolin-6-yl]carbamoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound L438-0286
methyl 2-({[8-fluoro-2-(morpholin-4-yl)quinolin-6-yl]carbamoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

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

L438-0286

Molecular Formula

C24H25FN4O4S (C24 H25 FN4 O4 S)

Compound Name

methyl 2-({[8-fluoro-2-(morpholin-4-yl)quinolin-6-yl]carbamoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

IUPAC name

methyl 2-({[8-fluoro-2-(morpholin-4-yl)quinolin-6-yl]carbamoyl}amino)-4567-tetrahydro-1-benzothiophene-3-carboxylate

SMILES

COC(c1c(NC(Nc2cc3ccc(N4CCOCC4)nc3c(F)c2)=O)sc2c1CCCC2)=O

InChI

InChI=1S/C24H25FN4O4S/c1-32-23(30)20-16-4-2-3-5-18(16)34-22(20)28-24(31)26-15-12-14-6-7-19(27-21(14)17(25)13-15)29-8-10-33-11-9-29/h6-7,12-13H,2-5,8-11H2,1H3,(H2,26,28,31)

InChI Key

QNNGCGCUSRYIKD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27252776

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.214

Distribution Coefficient, logD

2.847

Water Solubility, LogSw

-5.47

Polar Surface Area

73.356

Acid Dissociation Constant (pKa)

5.04

Base Dissociation Constant (pKb)

3.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

L438-0286 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Protein Arginine Methyltransferases Library (27925 compounds)

Akt-Targeted Library (14764 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

New Agro Library (44492 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Others
  • Kinases
  • Phosphatases
Mechanism of action:
  • Epigenetic
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with L438-0286 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L438-0286?
Check Price and Availability of L438-0286, 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 L438-0286 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L438-0286
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L438-0286
  • 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 L438-0286 available by request