J034-0946 Screening compound: N-{2-[1-(4-methoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-2-methylaniline

J034-0946 Screening compound: N-{2-[1-(4-methoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-2-methylaniline
J034-0946 Screening compound: N-{2-[1-(4-methoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-2-methylaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound J034-0946
N-{2-[1-(4-methoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]propan-2-yl}-2-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

J034-0946

Molecular Formula

C18H21N5O (C18 H21 N5 O)

Compound Name

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

IUPAC name

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

SMILES

CC(C)(c1nnnn1-c(cc1)ccc1OC)Nc1c(C)cccc1

InChI

InChI=1S/C18H21N5O/c1-13-7-5-6-8-16(13)19-18(2,3)17-20-21-22-23(17)14-9-11-15(24-4)12-10-14/h5-12,19H,1-4H3

InChI Key

WCTMIAQBPKJSAS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13369280

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.532

Distribution Coefficient, logD

3.532

Water Solubility, LogSw

-3.52

Polar Surface Area

55.672

Acid Dissociation Constant (pKa)

20.66

Base Dissociation Constant (pKb)

1.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

References: we are preparing a list of scientific research reports with J034-0946 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J034-0946?
Check Price and Availability of J034-0946, 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 J034-0946 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J034-0946
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J034-0946
  • 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 J034-0946 available by request