J034-0973 Screening compound: N-{2-[1-(4-methoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]butan-2-yl}-2-methylaniline

J034-0973 Screening compound: N-{2-[1-(4-methoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]butan-2-yl}-2-methylaniline
J034-0973 Screening compound: N-{2-[1-(4-methoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]butan-2-yl}-2-methylaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound J034-0973
N-{2-[1-(4-methoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]butan-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

J034-0973

Molecular Formula

C19H23N5O (C19 H23 N5 O)

Compound Name

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

IUPAC name

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

SMILES

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

InChI

InChI=1S/C19H23N5O/c1-5-19(3,20-17-9-7-6-8-14(17)2)18-21-22-23-24(18)15-10-12-16(25-4)13-11-15/h6-13,20H,5H2,1-4H3/t19-/m0/s1

InChI Key

JCJQXWKBJABNSN-IBGZPJMESA-N

MDL Number (MFCD)

MFCD13369275

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.138

Distribution Coefficient, logD

4.138

Water Solubility, LogSw

-4.13

Polar Surface Area

56.139

Acid Dissociation Constant (pKa)

21.06

Base Dissociation Constant (pKb)

1.91

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with J034-0973 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J034-0973?
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What is the minimum amount of J034-0973 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J034-0973
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J034-0973
  • 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 J034-0973 available by request