J067-0339 Screening compound: N-({3-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)oxy]phenyl}methyl)cycloheptanamine

J067-0339 Screening compound: N-({3-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)oxy]phenyl}methyl)cycloheptanamine
J067-0339 Screening compound: N-({3-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)oxy]phenyl}methyl)cycloheptanamine alternative view

Chemical Structure Depiction of ChemDiv screening compound J067-0339
N-({3-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)oxy]phenyl}methyl)cycloheptanamine

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

J067-0339

Molecular Formula

C21H25N5O (C21 H25 N5 O)

Compound Name

N-({3-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)oxy]phenyl}methyl)cycloheptanamine

IUPAC name

N-({3-[(1-phenyl-1H-1234-tetrazol-5-yl)oxy]phenyl}methyl)cycloheptanamine

SMILES

C(c1cccc(Oc2nnnn2-c2ccccc2)c1)NC1CCCCCC1

InChI

InChI=1S/C21H25N5O/c1-2-5-11-18(10-4-1)22-16-17-9-8-14-20(15-17)27-21-23-24-25-26(21)19-12-6-3-7-13-19/h3,6-9,12-15,18,22H,1-2,4-5,10-11,16H2

InChI Key

NTSCBPRZHIBADT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09688326

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

363.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.323

Distribution Coefficient, logD

1.579

Water Solubility, LogSw

-4.39

Polar Surface Area

58.240

Acid Dissociation Constant (pKa)

26.47

Base Dissociation Constant (pKb)

10.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

J067-0339 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with J067-0339 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J067-0339?
Check Price and Availability of J067-0339, 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 J067-0339 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J067-0339
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J067-0339
  • 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 J067-0339 available by request