G345-0726 Screening compound: 4-({6,7-dimethoxy-2,4-dioxo-1-[(phenylcarbamoyl)methyl]-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-(2-methoxyethyl)benzamide

G345-0726 Screening compound: 4-({6,7-dimethoxy-2,4-dioxo-1-[(phenylcarbamoyl)methyl]-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-(2-methoxyethyl)benzamide
G345-0726 Screening compound: 4-({6,7-dimethoxy-2,4-dioxo-1-[(phenylcarbamoyl)methyl]-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-(2-methoxyethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G345-0726
4-({6,7-dimethoxy-2,4-dioxo-1-[(phenylcarbamoyl)methyl]-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-(2-methoxyethyl)benzamide

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

G345-0726

Molecular Formula

C29H30N4O7 (C29 H30 N4 O7)

Compound Name

4-({6,7-dimethoxy-2,4-dioxo-1-[(phenylcarbamoyl)methyl]-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)-N-(2-methoxyethyl)benzamide

IUPAC name

4-({67-dimethoxy-24-dioxo-1-[(phenylcarbamoyl)methyl]-1234-tetrahydroquinazolin-3-yl}methyl)-N-(2-methoxyethyl)benzamide

SMILES

COCCNC(c1ccc(CN(C(c(cc(c(OC)c2)OC)c2N2CC(Nc3ccccc3)=O)=O)C2=O)cc1)=O

InChI

InChI=1S/C29H30N4O7/c1-38-14-13-30-27(35)20-11-9-19(10-12-20)17-33-28(36)22-15-24(39-2)25(40-3)16-23(22)32(29(33)37)18-26(34)31-21-7-5-4-6-8-21/h4-12,15-16H,13-14,17-18H2,1-3H3,(H,30,35)(H,31,34)

InChI Key

ZFKNOPXRZULNPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27136696

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

546.58

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.896

Distribution Coefficient, logD

2.896

Water Solubility, LogSw

-3.61

Polar Surface Area

102.546

Acid Dissociation Constant (pKa)

12.84

Base Dissociation Constant (pKb)

0.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.10

G345-0726 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with G345-0726 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G345-0726?
Check Price and Availability of G345-0726, 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 G345-0726 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G345-0726
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G345-0726
  • 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 G345-0726 available by request