L392-1349 Screening compound: ethyl 2-(4-methylphenyl)-4-oxo-3-{[(2,4,6-trimethylphenyl)carbamoyl]methyl}-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidine-7-carboxylate

L392-1349 Screening compound: ethyl 2-(4-methylphenyl)-4-oxo-3-{[(2,4,6-trimethylphenyl)carbamoyl]methyl}-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidine-7-carboxylate
L392-1349 Screening compound: ethyl 2-(4-methylphenyl)-4-oxo-3-{[(2,4,6-trimethylphenyl)carbamoyl]methyl}-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidine-7-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound L392-1349
ethyl 2-(4-methylphenyl)-4-oxo-3-{[(2,4,6-trimethylphenyl)carbamoyl]methyl}-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidine-7-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

L392-1349

Molecular Formula

C28H32N4O4 (C28 H32 N4 O4)

Compound Name

ethyl 2-(4-methylphenyl)-4-oxo-3-{[(2,4,6-trimethylphenyl)carbamoyl]methyl}-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidine-7-carboxylate

IUPAC name

ethyl 2-(4-methylphenyl)-4-oxo-3-{[(246-trimethylphenyl)carbamoyl]methyl}-3H4H5H6H7H8H-pyrido[34-d]pyrimidine-7-carboxylate

SMILES

CCOC(N(CC1)CC(N=C(c2ccc(C)cc2)N2CC(Nc3c(C)cc(C)cc3C)=O)=C1C2=O)=O

InChI

InChI=1S/C28H32N4O4/c1-6-36-28(35)31-12-11-22-23(15-31)29-26(21-9-7-17(2)8-10-21)32(27(22)34)16-24(33)30-25-19(4)13-18(3)14-20(25)5/h7-10,13-14H,6,11-12,15-16H2,1-5H3,(H,30,33)

InChI Key

VPIQKSOUPPGKMO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27250788

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.59

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.965

Distribution Coefficient, logD

3.964

Water Solubility, LogSw

-3.89

Polar Surface Area

69.788

Acid Dissociation Constant (pKa)

12.34

Base Dissociation Constant (pKb)

4.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

L392-1349 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with L392-1349 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L392-1349?
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What is the minimum amount of L392-1349 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L392-1349
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L392-1349
  • 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 L392-1349 available by request