C301-6208 Screening compound: N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine

C301-6208 Screening compound: N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine
C301-6208 Screening compound: N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-6208
N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine

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

C301-6208

Molecular Formula

C25H21ClFN3O (C25 H21 ClFN3 O)

Compound Name

N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine

IUPAC name

N-[(2-chloro-4-fluorophenyl)(5-phenyl-134-oxadiazol-2-yl)methyl]-5678-tetrahydronaphthalen-1-amine

SMILES

Fc1cc(Cl)c(C(c2nnc(-c3ccccc3)o2)Nc2c(CCCC3)c3ccc2)cc1

InChI

InChI=1S/C25H21ClFN3O/c26-21-15-18(27)13-14-20(21)23(25-30-29-24(31-25)17-8-2-1-3-9-17)28-22-12-6-10-16-7-4-5-11-19(16)22/h1-3,6,8-10,12-15,23,28H,4-5,7,11H2/t23-/m1/s1

InChI Key

YHBOGNMHRGQBRC-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD14744334

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.91

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.956

Distribution Coefficient, logD

6.956

Water Solubility, LogSw

-6.79

Polar Surface Area

39.292

Acid Dissociation Constant (pKa)

17.91

Base Dissociation Constant (pKb)

-2.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

C301-6208 in Drug Discovery

Included in Screening Libraries

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

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C301-6208 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-6208?
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What is the minimum amount of C301-6208 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-6208
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-6208
  • 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 C301-6208 available by request