8014-8955 Screening compound: N-(2-butoxyphenyl)-2-[5-(2-chlorophenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamide

8014-8955 Screening compound: N-(2-butoxyphenyl)-2-[5-(2-chlorophenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamide
8014-8955 Screening compound: N-(2-butoxyphenyl)-2-[5-(2-chlorophenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-8955
N-(2-butoxyphenyl)-2-[5-(2-chlorophenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamide

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

8014-8955

Molecular Formula

C19H20ClN5O2 (C19 H20 ClN5 O2)

Compound Name

N-(2-butoxyphenyl)-2-[5-(2-chlorophenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamide

IUPAC name

N-(2-butoxyphenyl)-2-[5-(2-chlorophenyl)-2H-1234-tetrazol-2-yl]acetamide

SMILES

CCCCOc(cccc1)c1NC(Cn1nnc(-c(cccc2)c2Cl)n1)=O

InChI

InChI=1S/C19H20ClN5O2/c1-2-3-12-27-17-11-7-6-10-16(17)21-18(26)13-25-23-19(22-24-25)14-8-4-5-9-15(14)20/h4-11H,2-3,12-13H2,1H3,(H,21,26)

InChI Key

LLRCAAQNSMZJQU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03820740

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.85

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.374

Distribution Coefficient, logD

4.374

Water Solubility, LogSw

-4.47

Polar Surface Area

68.298

Acid Dissociation Constant (pKa)

11.65

Base Dissociation Constant (pKb)

2.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with 8014-8955 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-8955?
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What is the minimum amount of 8014-8955 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-8955
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-8955
  • 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 8014-8955 available by request