D272-0561 Screening compound: ({3-[(2-fluorophenyl)methoxy]phenyl}methyl)({3-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]propyl})amine

D272-0561 Screening compound: ({3-[(2-fluorophenyl)methoxy]phenyl}methyl)({3-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]propyl})amine
D272-0561 Screening compound: ({3-[(2-fluorophenyl)methoxy]phenyl}methyl)({3-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]propyl})amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D272-0561
({3-[(2-fluorophenyl)methoxy]phenyl}methyl)({3-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]propyl})amine

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

D272-0561

Molecular Formula

C19H22FN5OS (C19 H22 FN5 OS)

Compound Name

({3-[(2-fluorophenyl)methoxy]phenyl}methyl)({3-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]propyl})amine

IUPAC name

({3-[(2-fluorophenyl)methoxy]phenyl}methyl)({3-[(1-methyl-1H-1234-tetrazol-5-yl)sulfanyl]propyl})amine

SMILES

Cn1nnnc1SCCCNCc1cc(OCc(cccc2)c2F)ccc1

InChI

InChI=1S/C19H22FN5OS/c1-25-19(22-23-24-25)27-11-5-10-21-13-15-6-4-8-17(12-15)26-14-16-7-2-3-9-18(16)20/h2-4,6-9,12,21H,5,10-11,13-14H2,1H3

InChI Key

FYNCPMWJWMPZRT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07434566

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

387.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.661

Distribution Coefficient, logD

-0.977

Water Solubility, LogSw

-2.96

Polar Surface Area

59.417

Acid Dissociation Constant (pKa)

25.04

Base Dissociation Constant (pKb)

11.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

D272-0561 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral Annotated Library (21441 compounds)

Human Kinases Annotated Library (2415 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with D272-0561 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D272-0561?
Check Price and Availability of D272-0561, 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 D272-0561 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D272-0561
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D272-0561
  • 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 D272-0561 available by request