J034-0669 Screening compound: 1-[1-(2,6-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]-N-(2-phenylethyl)cyclopentan-1-amine

J034-0669 Screening compound: 1-[1-(2,6-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]-N-(2-phenylethyl)cyclopentan-1-amine
J034-0669 Screening compound: 1-[1-(2,6-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]-N-(2-phenylethyl)cyclopentan-1-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound J034-0669
1-[1-(2,6-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]-N-(2-phenylethyl)cyclopentan-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

J034-0669

Molecular Formula

C22H27N5 (C22 H27 N5)

Compound Name

1-[1-(2,6-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]-N-(2-phenylethyl)cyclopentan-1-amine

IUPAC name

1-[1-(26-dimethylphenyl)-1H-1234-tetrazol-5-yl]-N-(2-phenylethyl)cyclopentan-1-amine

SMILES

Cc1cccc(C)c1-n1nnnc1C1(CCCC1)NCCc1ccccc1

InChI

InChI=1S/C22H27N5/c1-17-9-8-10-18(2)20(17)27-21(24-25-26-27)22(14-6-7-15-22)23-16-13-19-11-4-3-5-12-19/h3-5,8-12,23H,6-7,13-16H2,1-2H3

InChI Key

CPCCOMUMUDZLOZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13369560

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.363

Distribution Coefficient, logD

4.295

Water Solubility, LogSw

-4.36

Polar Surface Area

50.233

Acid Dissociation Constant (pKa)

23.19

Base Dissociation Constant (pKb)

6.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

J034-0669 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with J034-0669 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J034-0669?
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What is the minimum amount of J034-0669 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J034-0669
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J034-0669
  • 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 J034-0669 available by request