G282-2116 Screening compound: methyl 2-(6-{[(4-methoxyphenyl)methyl]carbamoyl}-6-methyl-8-oxo-7-propyl-5H,6H,7H,8H-imidazo[1,5-a]pyrazine-1-amido)benzoate

G282-2116 Screening compound: methyl 2-(6-{[(4-methoxyphenyl)methyl]carbamoyl}-6-methyl-8-oxo-7-propyl-5H,6H,7H,8H-imidazo[1,5-a]pyrazine-1-amido)benzoate
G282-2116 Screening compound: methyl 2-(6-{[(4-methoxyphenyl)methyl]carbamoyl}-6-methyl-8-oxo-7-propyl-5H,6H,7H,8H-imidazo[1,5-a]pyrazine-1-amido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G282-2116
methyl 2-(6-{[(4-methoxyphenyl)methyl]carbamoyl}-6-methyl-8-oxo-7-propyl-5H,6H,7H,8H-imidazo[1,5-a]pyrazine-1-amido)benzoate

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

G282-2116

Molecular Formula

C28H31N5O6 (C28 H31 N5 O6)

Compound Name

methyl 2-(6-{[(4-methoxyphenyl)methyl]carbamoyl}-6-methyl-8-oxo-7-propyl-5H,6H,7H,8H-imidazo[1,5-a]pyrazine-1-amido)benzoate

IUPAC name

methyl 2-(6-{[(4-methoxyphenyl)methyl]carbamoyl}-6-methyl-8-oxo-7-propyl-5H6H7H8H-imidazo[15-a]pyrazine-1-amido)benzoate

SMILES

CCCN(C(C)(Cn1c2c(C(Nc(cccc3)c3C(OC)=O)=O)nc1)C(NCc(cc1)ccc1OC)=O)C2=O

InChI

InChI=1S/C28H31N5O6/c1-5-14-33-25(35)23-22(24(34)31-21-9-7-6-8-20(21)26(36)39-4)30-17-32(23)16-28(33,2)27(37)29-15-18-10-12-19(38-3)13-11-18/h6-13,17H,5,14-16H2,1-4H3,(H,29,37)(H,31,34)/t28-/m0/s1

InChI Key

UIZMMUWTYMNSJB-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD27212877

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

533.58

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.755

Distribution Coefficient, logD

2.728

Water Solubility, LogSw

-3.24

Polar Surface Area

103.046

Acid Dissociation Constant (pKa)

8.59

Base Dissociation Constant (pKb)

0.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.10

G282-2116 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Cyclic Ugi PPI Library (9586 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Mimetics
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with G282-2116 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G282-2116?
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What is the minimum amount of G282-2116 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G282-2116
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G282-2116
  • 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 G282-2116 available by request