J034-1089 Screening compound: {2-[1-(4-chlorophenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}(ethyl)amine

J034-1089 Screening compound: {2-[1-(4-chlorophenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}(ethyl)amine
J034-1089 Screening compound: {2-[1-(4-chlorophenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}(ethyl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound J034-1089
{2-[1-(4-chlorophenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}(ethyl)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

J034-1089

Molecular Formula

C12H16ClN5 (C12 H16 ClN5)

Compound Name

{2-[1-(4-chlorophenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}(ethyl)amine

IUPAC name

{2-[1-(4-chlorophenyl)-1H-1234-tetrazol-5-yl]propan-2-yl}(ethyl)amine

SMILES

CCNC(C)(C)c1nnnn1-c(cc1)ccc1Cl

InChI

InChI=1S/C12H16ClN5/c1-4-14-12(2,3)11-15-16-17-18(11)10-7-5-9(13)6-8-10/h5-8,14H,4H2,1-3H3

InChI Key

NKTZNZCYBDDWNE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27221416

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

265.75

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.546

Distribution Coefficient, logD

2.520

Water Solubility, LogSw

-3.29

Polar Surface Area

50.045

Acid Dissociation Constant (pKa)

22.83

Base Dissociation Constant (pKb)

6.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

References: we are preparing a list of scientific research reports with J034-1089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J034-1089?
Check Price and Availability of J034-1089, 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 J034-1089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J034-1089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J034-1089
  • 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 J034-1089 available by request