V028-4046 Screening compound: 4-({[2-(DIMETHYLAMINO)ETHYL][2-(2-THIENYL)ACETYL]AMINO}METHYL)PHENYL 4-FLUORO-1-BENZENESULFONATE

V028-4046 Screening compound: 4-({[2-(DIMETHYLAMINO)ETHYL][2-(2-THIENYL)ACETYL]AMINO}METHYL)PHENYL 4-FLUORO-1-BENZENESULFONATE
V028-4046 Screening compound: 4-({[2-(DIMETHYLAMINO)ETHYL][2-(2-THIENYL)ACETYL]AMINO}METHYL)PHENYL 4-FLUORO-1-BENZENESULFONATE alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-4046
4-({[2-(DIMETHYLAMINO)ETHYL][2-(2-THIENYL)ACETYL]AMINO}METHYL)PHENYL 4-FLUORO-1-BENZENESULFONATE

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

V028-4046

Molecular Formula

C23H25FN2O4S2 (C23 H25 FN2 O4 S2)

Compound Name

4-({[2-(DIMETHYLAMINO)ETHYL][2-(2-THIENYL)ACETYL]AMINO}METHYL)PHENYL 4-FLUORO-1-BENZENESULFONATE

IUPAC name

n/a

SMILES

CN(C)CCN(Cc(cc1)ccc1OS(c(cc1)ccc1F)(=O)=O)C(Cc1cccs1)=O

InChI

InChI=1S/C23H25FN2O4S2/c1-25(2)13-14-26(23(27)16-21-4-3-15-31-21)17-18-5-9-20(10-6-18)30-32(28,29)22-11-7-19(24)8-12-22/h3-12,15H,13-14,16-17H2,1-2H3

InChI Key

AYQPOOJLLRTNHY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19973207

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

476.59

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.476

Distribution Coefficient, logD

2.525

Water Solubility, LogSw

-3.68

Polar Surface Area

56.546

Acid Dissociation Constant (pKa)

22.05

Base Dissociation Constant (pKb)

8.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with V028-4046 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-4046?
Check Price and Availability of V028-4046, 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 V028-4046 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-4046
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-4046
  • 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 V028-4046 available by request