J034-0718 Screening compound: 1-[1-(2,6-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]-4-methylcyclohexan-1-amine

J034-0718 Screening compound: 1-[1-(2,6-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]-4-methylcyclohexan-1-amine
J034-0718 Screening compound: 1-[1-(2,6-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]-4-methylcyclohexan-1-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound J034-0718
1-[1-(2,6-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]-4-methylcyclohexan-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

J034-0718

Molecular Formula

C16H23N5 (C16 H23 N5)

Compound Name

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

IUPAC name

1-[1-(26-dimethylphenyl)-1H-1234-tetrazol-5-yl]-4-methylcyclohexan-1-amine

SMILES

CC(CC1)CCC1(c1nnnn1-c1c(C)cccc1C)N

InChI

InChI=1S/C16H23N5/c1-11-7-9-16(17,10-8-11)15-18-19-20-21(15)14-12(2)5-4-6-13(14)3/h4-6,11H,7-10,17H2,1-3H3

InChI Key

FFQRZHQRJGUZGP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00485529

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

285.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.088

Distribution Coefficient, logD

3.059

Water Solubility, LogSw

-3.07

Polar Surface Area

59.237

Acid Dissociation Constant (pKa)

22.48

Base Dissociation Constant (pKb)

6.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.30

J034-0718 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 J034-0718 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J034-0718?
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What is the minimum amount of J034-0718 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J034-0718
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J034-0718
  • 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 J034-0718 available by request