J034-1269 Screening compound: 1-{2-[1-(2-ethyl-6-methylphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-4-(furan-2-carbonyl)piperazine

J034-1269 Screening compound: 1-{2-[1-(2-ethyl-6-methylphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-4-(furan-2-carbonyl)piperazine
J034-1269 Screening compound: 1-{2-[1-(2-ethyl-6-methylphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-4-(furan-2-carbonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound J034-1269
1-{2-[1-(2-ethyl-6-methylphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-4-(furan-2-carbonyl)piperazine

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

J034-1269

Molecular Formula

C22H28N6O2 (C22 H28 N6 O2)

Compound Name

1-{2-[1-(2-ethyl-6-methylphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-4-(furan-2-carbonyl)piperazine

IUPAC name

1-{2-[1-(2-ethyl-6-methylphenyl)-1H-1234-tetrazol-5-yl]propan-2-yl}-4-(furan-2-carbonyl)piperazine

SMILES

CCc(cccc1C)c1-n1nnnc1C(C)(C)N(CC1)CCN1C(c1ccco1)=O

InChI

InChI=1S/C22H28N6O2/c1-5-17-9-6-8-16(2)19(17)28-21(23-24-25-28)22(3,4)27-13-11-26(12-14-27)20(29)18-10-7-15-30-18/h6-10,15H,5,11-14H2,1-4H3

InChI Key

SQDWOFNQXQQGNK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27221445

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.380

Distribution Coefficient, logD

3.380

Water Solubility, LogSw

-3.21

Polar Surface Area

67.779

Acid Dissociation Constant (pKa)

23.42

Base Dissociation Constant (pKb)

3.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

J034-1269 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with J034-1269 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J034-1269?
Check Price and Availability of J034-1269, 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 J034-1269 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J034-1269
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J034-1269
  • 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 J034-1269 available by request