E870-0184 Screening compound: METHYL 3-{[5-(2-CHLOROBENZYL)-1

E870-0184 Screening compound: METHYL 3-{[5-(2-CHLOROBENZYL)-1
E870-0184 Screening compound: METHYL 3-{[5-(2-CHLOROBENZYL)-1 alternative view

Chemical Structure Depiction of ChemDiv screening compound E870-0184
METHYL 3-{[5-(2-CHLOROBENZYL)-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

E870-0184

Molecular Formula

C19H21ClN2O5S (C19 H21 ClN2 O5 S)

Compound Name

METHYL 3-{[5-(2-CHLOROBENZYL)-1

IUPAC name

n/a

SMILES

COC(c(cc1)cc(CN(CCN2Cc(cccc3)c3Cl)S2(=O)=O)c1OC)=O

InChI

InChI=1S/C19H21ClN2O5S/c1-26-18-8-7-14(19(23)27-2)11-16(18)13-22-10-9-21(28(22,24)25)12-15-5-3-4-6-17(15)20/h3-8,11H,9-10,12-13H2,1-2H3

InChI Key

QTCLTVDZXMLATA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14925060

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.9

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.442

Distribution Coefficient, logD

3.442

Water Solubility, LogSw

-3.85

Polar Surface Area

65.549

Acid Dissociation Constant (pKa)

28.41

Base Dissociation Constant (pKb)

-4.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.00

References: we are preparing a list of scientific research reports with E870-0184 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E870-0184?
Check Price and Availability of E870-0184, 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 E870-0184 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E870-0184
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E870-0184
  • 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 E870-0184 available by request