J034-0014 Screening compound: N-{2-[1-(3,4-dimethoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-4-methylaniline

J034-0014 Screening compound: N-{2-[1-(3,4-dimethoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-4-methylaniline
J034-0014 Screening compound: N-{2-[1-(3,4-dimethoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-4-methylaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound J034-0014
N-{2-[1-(3,4-dimethoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-4-methylaniline

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

J034-0014

Molecular Formula

C19H23N5O2 (C19 H23 N5 O2)

Compound Name

N-{2-[1-(3,4-dimethoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-4-methylaniline

IUPAC name

N-{2-[1-(34-dimethoxyphenyl)-1H-1234-tetrazol-5-yl]propan-2-yl}-4-methylaniline

SMILES

CC(C)(c1nnnn1-c(cc1)cc(OC)c1OC)Nc1ccc(C)cc1

InChI

InChI=1S/C19H23N5O2/c1-13-6-8-14(9-7-13)20-19(2,3)18-21-22-23-24(18)15-10-11-16(25-4)17(12-15)26-5/h6-12,20H,1-5H3

InChI Key

XBRKNPDGQPOIKJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27221341

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.572

Distribution Coefficient, logD

3.572

Water Solubility, LogSw

-3.60

Polar Surface Area

64.087

Acid Dissociation Constant (pKa)

20.77

Base Dissociation Constant (pKb)

1.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

J034-0014 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with J034-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J034-0014?
Check Price and Availability of J034-0014, 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 J034-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J034-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J034-0014
  • 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 J034-0014 available by request