G745-1478 Screening compound: N-{[1-(4-fluorophenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}-2,4-dimethoxybenzamide

G745-1478 Screening compound: N-{[1-(4-fluorophenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}-2,4-dimethoxybenzamide
G745-1478 Screening compound: N-{[1-(4-fluorophenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}-2,4-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G745-1478
N-{[1-(4-fluorophenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}-2,4-dimethoxybenzamide

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

G745-1478

Molecular Formula

C17H16FN5O3 (C17 H16 FN5 O3)

Compound Name

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

IUPAC name

N-{[1-(4-fluorophenyl)-1H-1234-tetrazol-5-yl]methyl}-24-dimethoxybenzamide

SMILES

COc(cc1)cc(OC)c1C(NCc1nnnn1-c(cc1)ccc1F)=O

InChI

InChI=1S/C17H16FN5O3/c1-25-13-7-8-14(15(9-13)26-2)17(24)19-10-16-20-21-22-23(16)12-5-3-11(18)4-6-12/h3-9H,10H2,1-2H3,(H,19,24)

InChI Key

XDTKKUVBGPVVRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08321329

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.34

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.331

Distribution Coefficient, logD

2.331

Water Solubility, LogSw

-2.98

Polar Surface Area

80.142

Acid Dissociation Constant (pKa)

11.70

Base Dissociation Constant (pKb)

-3.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

G745-1478 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with G745-1478 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G745-1478?
Check Price and Availability of G745-1478, 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 G745-1478 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G745-1478
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G745-1478
  • 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 G745-1478 available by request