G745-0041 Screening compound: N-{[1-(3,4-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}-3,4-diethoxybenzamide

G745-0041 Screening compound: N-{[1-(3,4-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}-3,4-diethoxybenzamide
G745-0041 Screening compound: N-{[1-(3,4-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}-3,4-diethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G745-0041
N-{[1-(3,4-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}-3,4-diethoxybenzamide

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

G745-0041

Molecular Formula

C21H25N5O3 (C21 H25 N5 O3)

Compound Name

N-{[1-(3,4-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}-3,4-diethoxybenzamide

IUPAC name

N-{[1-(34-dimethylphenyl)-1H-1234-tetrazol-5-yl]methyl}-34-diethoxybenzamide

SMILES

CCOc(ccc(C(NCc1nnnn1-c1cc(C)c(C)cc1)=O)c1)c1OCC

InChI

InChI=1S/C21H25N5O3/c1-5-28-18-10-8-16(12-19(18)29-6-2)21(27)22-13-20-23-24-25-26(20)17-9-7-14(3)15(4)11-17/h7-12H,5-6,13H2,1-4H3,(H,22,27)

InChI Key

UBLKNSYKMXMFKU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08319870

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.222

Distribution Coefficient, logD

3.222

Water Solubility, LogSw

-3.18

Polar Surface Area

79.389

Acid Dissociation Constant (pKa)

13.59

Base Dissociation Constant (pKb)

-2.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

G745-0041 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G745-0041 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G745-0041?
Check Price and Availability of G745-0041, 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 G745-0041 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G745-0041
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G745-0041
  • 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 G745-0041 available by request