F846-0137 Screening compound: 6-CHLORO-N3-(2-METHOXYBENZYL)-2-METHYL-1

F846-0137 Screening compound: 6-CHLORO-N3-(2-METHOXYBENZYL)-2-METHYL-1
F846-0137 Screening compound: 6-CHLORO-N3-(2-METHOXYBENZYL)-2-METHYL-1 alternative view

Chemical Structure Depiction of ChemDiv screening compound F846-0137
6-CHLORO-N3-(2-METHOXYBENZYL)-2-METHYL-1

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

F846-0137

Molecular Formula

C24H21ClN2O4S (C24 H21 ClN2 O4 S)

Compound Name

6-CHLORO-N3-(2-METHOXYBENZYL)-2-METHYL-1

IUPAC name

n/a

SMILES

CN(C(C(NCc(cccc1)c1OC)=O)=C(c1ccccc1)c1c2ccc(Cl)c1)S2(=O)=O

InChI

InChI=1S/C24H21ClN2O4S/c1-27-23(24(28)26-15-17-10-6-7-11-20(17)31-2)22(16-8-4-3-5-9-16)19-14-18(25)12-13-21(19)32(27,29)30/h3-14H,15H2,1-2H3,(H,26,28)

InChI Key

XELWOJYYTBTBCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14967717

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.96

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.535

Distribution Coefficient, logD

5.534

Water Solubility, LogSw

-5.86

Polar Surface Area

64.721

Acid Dissociation Constant (pKa)

10.72

Base Dissociation Constant (pKb)

-1.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

F846-0137 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F846-0137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F846-0137?
Check Price and Availability of F846-0137, 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 F846-0137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F846-0137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F846-0137
  • 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 F846-0137 available by request