V001-8029 Screening compound: 3-{[N-(2-methoxyethyl)-1-(thiophen-2-yl)formamido]methyl}phenyl propane-2-sulfonate

V001-8029 Screening compound: 3-{[N-(2-methoxyethyl)-1-(thiophen-2-yl)formamido]methyl}phenyl propane-2-sulfonate
V001-8029 Screening compound: 3-{[N-(2-methoxyethyl)-1-(thiophen-2-yl)formamido]methyl}phenyl propane-2-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-8029
3-{[N-(2-methoxyethyl)-1-(thiophen-2-yl)formamido]methyl}phenyl propane-2-sulfonate

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

V001-8029

Molecular Formula

C18H23NO5S2 (C18 H23 NO5 S2)

Compound Name

3-{[N-(2-methoxyethyl)-1-(thiophen-2-yl)formamido]methyl}phenyl propane-2-sulfonate

IUPAC name

3-{[N-(2-methoxyethyl)-1-(thiophen-2-yl)formamido]methyl}phenyl propane-2-sulfonate

SMILES

CC(C)S(Oc1cc(CN(CCOC)C(c2cccs2)=O)ccc1)(=O)=O

InChI

InChI=1S/C18H23NO5S2/c1-14(2)26(21,22)24-16-7-4-6-15(12-16)13-19(9-10-23-3)18(20)17-8-5-11-25-17/h4-8,11-12,14H,9-10,13H2,1-3H3

InChI Key

SWNKXFSLBUOAMG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19788611

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.844

Distribution Coefficient, logD

2.844

Water Solubility, LogSw

-3.40

Polar Surface Area

61.822

Acid Dissociation Constant (pKa)

19.26

Base Dissociation Constant (pKb)

-2.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

References: we are preparing a list of scientific research reports with V001-8029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-8029?
Check Price and Availability of V001-8029, 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 V001-8029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-8029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-8029
  • 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 V001-8029 available by request