G418-0742 Screening compound: ethyl 4-{[({[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl](phenyl)methyl}carbamoyl)amino]methyl}cyclohexane-1-carboxylate

G418-0742 Screening compound: ethyl 4-{[({[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl](phenyl)methyl}carbamoyl)amino]methyl}cyclohexane-1-carboxylate
G418-0742 Screening compound: ethyl 4-{[({[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl](phenyl)methyl}carbamoyl)amino]methyl}cyclohexane-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G418-0742
ethyl 4-{[({[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl](phenyl)methyl}carbamoyl)amino]methyl}cyclohexane-1-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

G418-0742

Molecular Formula

C26H29ClN4O4 (C26 H29 ClN4 O4)

Compound Name

ethyl 4-{[({[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl](phenyl)methyl}carbamoyl)amino]methyl}cyclohexane-1-carboxylate

IUPAC name

ethyl 4-{[({[5-(2-chlorophenyl)-134-oxadiazol-2-yl](phenyl)methyl}carbamoyl)amino]methyl}cyclohexane-1-carboxylate

SMILES

CCOC(C1CCC(CNC(NC(c2nnc(-c(cccc3)c3Cl)o2)c2ccccc2)=O)CC1)=O

InChI

InChI=1S/C26H29ClN4O4/c1-2-34-25(32)19-14-12-17(13-15-19)16-28-26(33)29-22(18-8-4-3-5-9-18)24-31-30-23(35-24)20-10-6-7-11-21(20)27/h3-11,17,19,22H,2,12-16H2,1H3,(H2,28,29,33)/t17?,19?,22-/m1/s1

InChI Key

KPVHVEOAOZTCLS-RKOYOZNISA-N

MDL Number (MFCD)

MFCD12129776

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.99

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.958

Distribution Coefficient, logD

4.958

Water Solubility, LogSw

-4.91

Polar Surface Area

85.728

Acid Dissociation Constant (pKa)

12.26

Base Dissociation Constant (pKb)

1.92

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

G418-0742 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • Phosphatases

References: we are preparing a list of scientific research reports with G418-0742 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G418-0742?
Check Price and Availability of G418-0742, 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 G418-0742 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G418-0742
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G418-0742
  • 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 G418-0742 available by request