L392-0811 Screening compound: 2-{7-benzyl-4-oxo-2-[4-(trifluoromethyl)phenyl]-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-3-yl}acetamide

L392-0811 Screening compound: 2-{7-benzyl-4-oxo-2-[4-(trifluoromethyl)phenyl]-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-3-yl}acetamide
L392-0811 Screening compound: 2-{7-benzyl-4-oxo-2-[4-(trifluoromethyl)phenyl]-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-3-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L392-0811
2-{7-benzyl-4-oxo-2-[4-(trifluoromethyl)phenyl]-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-3-yl}acetamide

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

L392-0811

Molecular Formula

C23H21F3N4O2 (C23 H21 F3 N4 O2)

Compound Name

2-{7-benzyl-4-oxo-2-[4-(trifluoromethyl)phenyl]-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-3-yl}acetamide

IUPAC name

2-{7-benzyl-4-oxo-2-[4-(trifluoromethyl)phenyl]-3H4H5H6H7H8H-pyrido[34-d]pyrimidin-3-yl}acetamide

SMILES

NC(CN(C(c1ccc(C(F)(F)F)cc1)=NC1=C2CCN(Cc3ccccc3)C1)C2=O)=O

InChI

InChI=1S/C23H21F3N4O2/c24-23(25,26)17-8-6-16(7-9-17)21-28-19-13-29(12-15-4-2-1-3-5-15)11-10-18(19)22(32)30(21)14-20(27)31/h1-9H,10-14H2,(H2,27,31)

InChI Key

OYTBULXCVUBZJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16639368

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.521

Distribution Coefficient, logD

1.596

Water Solubility, LogSw

-2.58

Polar Surface Area

62.454

Acid Dissociation Constant (pKa)

15.78

Base Dissociation Constant (pKb)

8.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

L392-0811 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Nervous system
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L392-0811 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L392-0811?
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What is the minimum amount of L392-0811 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L392-0811
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L392-0811
  • 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 L392-0811 available by request