G714-0059 Screening compound: ethyl 3-({[(1-acetyl-2,3-dihydro-1H-indol-5-yl)methyl]carbamoyl}amino)-3-phenylpropanoate

G714-0059 Screening compound: ethyl 3-({[(1-acetyl-2,3-dihydro-1H-indol-5-yl)methyl]carbamoyl}amino)-3-phenylpropanoate
G714-0059 Screening compound: ethyl 3-({[(1-acetyl-2,3-dihydro-1H-indol-5-yl)methyl]carbamoyl}amino)-3-phenylpropanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G714-0059
ethyl 3-({[(1-acetyl-2,3-dihydro-1H-indol-5-yl)methyl]carbamoyl}amino)-3-phenylpropanoate

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

G714-0059

Molecular Formula

C23H27N3O4 (C23 H27 N3 O4)

Compound Name

ethyl 3-({[(1-acetyl-2,3-dihydro-1H-indol-5-yl)methyl]carbamoyl}amino)-3-phenylpropanoate

IUPAC name

ethyl 3-({[(1-acetyl-23-dihydro-1H-indol-5-yl)methyl]carbamoyl}amino)-3-phenylpropanoate

SMILES

CCOC(CC(c1ccccc1)NC(NCc(cc1)cc(CC2)c1N2C(C)=O)=O)=O

InChI

InChI=1S/C23H27N3O4/c1-3-30-22(28)14-20(18-7-5-4-6-8-18)25-23(29)24-15-17-9-10-21-19(13-17)11-12-26(21)16(2)27/h4-10,13,20H,3,11-12,14-15H2,1-2H3,(H2,24,25,29)/t20-/m0/s1

InChI Key

QXVVOVYXXXWDCY-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD27153273

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.325

Distribution Coefficient, logD

2.325

Water Solubility, LogSw

-2.86

Polar Surface Area

71.393

Acid Dissociation Constant (pKa)

14.45

Base Dissociation Constant (pKb)

3.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.80

G714-0059 in Drug Discovery

Included in Screening Libraries

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

Integrin Receptors Targeted library (1715 compounds)

Antibacterial Compounds Library (13827 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
Targets:
  • Others
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with G714-0059 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G714-0059?
Check Price and Availability of G714-0059, 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 G714-0059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G714-0059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G714-0059
  • 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 G714-0059 available by request