G745-0031 Screening compound: N-{[1-(3,4-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}-4-methoxybenzamide

G745-0031 Screening compound: N-{[1-(3,4-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}-4-methoxybenzamide
G745-0031 Screening compound: N-{[1-(3,4-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}-4-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G745-0031
N-{[1-(3,4-dimethylphenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}-4-methoxybenzamide

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

G745-0031

Molecular Formula

C18H19N5O2 (C18 H19 N5 O2)

Compound Name

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

IUPAC name

N-{[1-(34-dimethylphenyl)-1H-1234-tetrazol-5-yl]methyl}-4-methoxybenzamide

SMILES

Cc(cc1)c(C)cc1-n1nnnc1CNC(c(cc1)ccc1OC)=O

InChI

InChI=1S/C18H19N5O2/c1-12-4-7-15(10-13(12)2)23-17(20-21-22-23)11-19-18(24)14-5-8-16(25-3)9-6-14/h4-10H,11H2,1-3H3,(H,19,24)

InChI Key

HYBSUYFVMIXCSX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07803472

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.089

Distribution Coefficient, logD

3.089

Water Solubility, LogSw

-3.27

Polar Surface Area

72.512

Acid Dissociation Constant (pKa)

12.98

Base Dissociation Constant (pKb)

-2.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

G745-0031 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G745-0031 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G745-0031?
Check Price and Availability of G745-0031, 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 G745-0031 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G745-0031
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G745-0031
  • 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 G745-0031 available by request