D453-0630 Screening compound: 4-(1H-1,2,3,4-tetrazol-1-yl)phenyl 2-phenylacetate

D453-0630 Screening compound: 4-(1H-1,2,3,4-tetrazol-1-yl)phenyl 2-phenylacetate
D453-0630 Screening compound: 4-(1H-1,2,3,4-tetrazol-1-yl)phenyl 2-phenylacetate alternative view

Chemical Structure Depiction of ChemDiv screening compound D453-0630
4-(1H-1,2,3,4-tetrazol-1-yl)phenyl 2-phenylacetate

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

D453-0630

Molecular Formula

C15H12N4O2 (C15 H12 N4 O2)

Compound Name

4-(1H-1,2,3,4-tetrazol-1-yl)phenyl 2-phenylacetate

IUPAC name

4-(1H-1234-tetrazol-1-yl)phenyl 2-phenylacetate

SMILES

O=C(Cc1ccccc1)Oc(cc1)ccc1-n1nnnc1

InChI

InChI=1S/C15H12N4O2/c20-15(10-12-4-2-1-3-5-12)21-14-8-6-13(7-9-14)19-11-16-17-18-19/h1-9,11H,10H2

InChI Key

VHPWDQAMNUYDCV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07264226

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

280.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.654

Distribution Coefficient, logD

2.654

Water Solubility, LogSw

-3.04

Polar Surface Area

59.787

Acid Dissociation Constant (pKa)

16.24

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

References: we are preparing a list of scientific research reports with D453-0630 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D453-0630?
Check Price and Availability of D453-0630, 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 D453-0630 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D453-0630
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D453-0630
  • 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 D453-0630 available by request