8017-9190 Screening compound: 1-(5-isopropyl-4-methoxy-2-methylphenyl)-1H-1,2,3,4-tetraazole

8017-9190 Screening compound: 1-(5-isopropyl-4-methoxy-2-methylphenyl)-1H-1,2,3,4-tetraazole
8017-9190 Screening compound: 1-(5-isopropyl-4-methoxy-2-methylphenyl)-1H-1,2,3,4-tetraazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-9190
1-(5-isopropyl-4-methoxy-2-methylphenyl)-1H-1,2,3,4-tetraazole

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

8017-9190

Molecular Formula

C12H16N4O (C12 H16 N4 O)

Compound Name

1-(5-isopropyl-4-methoxy-2-methylphenyl)-1H-1,2,3,4-tetraazole

IUPAC name

1-[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]-1H-1234-tetrazole

SMILES

CC(C)c(cc(c(C)c1)-n2nnnc2)c1OC

InChI

InChI=1S/C12H16N4O/c1-8(2)10-6-11(16-7-13-14-15-16)9(3)5-12(10)17-4/h5-8H,1-4H3

InChI Key

MTGPGGVIPPZHSR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06619220

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

232.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.088

Distribution Coefficient, logD

3.088

Water Solubility, LogSw

-3.13

Polar Surface Area

47.333

Acid Dissociation Constant (pKa)

22.83

Base Dissociation Constant (pKb)

-0.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.67

References: we are preparing a list of scientific research reports with 8017-9190 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-9190?
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What is the minimum amount of 8017-9190 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-9190
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-9190
  • 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 8017-9190 available by request