C301-8197 Screening compound: N-[(4-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide

C301-8197 Screening compound: N-[(4-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide
C301-8197 Screening compound: N-[(4-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-8197
N-[(4-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide

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

C301-8197

Molecular Formula

C25H22ClN3O5 (C25 H22 ClN3 O5)

Compound Name

N-[(4-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,4,5-trimethoxybenzamide

IUPAC name

N-[(4-chlorophenyl)(5-phenyl-134-oxadiazol-2-yl)methyl]-345-trimethoxybenzamide

SMILES

COc1cc(C(NC(c2nnc(-c3ccccc3)o2)c(cc2)ccc2Cl)=O)cc(OC)c1OC

InChI

InChI=1S/C25H22ClN3O5/c1-31-19-13-17(14-20(32-2)22(19)33-3)23(30)27-21(15-9-11-18(26)12-10-15)25-29-28-24(34-25)16-7-5-4-6-8-16/h4-14,21H,1-3H3,(H,27,30)/t21-/m1/s1

InChI Key

XLEWTQFVJBPCHG-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD12129543

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.92

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.366

Distribution Coefficient, logD

4.366

Water Solubility, LogSw

-4.92

Polar Surface Area

77.226

Acid Dissociation Constant (pKa)

10.75

Base Dissociation Constant (pKb)

-5.89

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.00

C301-8197 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C301-8197 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-8197?
Check Price and Availability of C301-8197, 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 C301-8197 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-8197
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-8197
  • 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 C301-8197 available by request