V027-5124 Screening compound: 3-{[(ethylcarbamoyl)(propan-2-yl)amino]methyl}phenyl propane-2-sulfonate

V027-5124 Screening compound: 3-{[(ethylcarbamoyl)(propan-2-yl)amino]methyl}phenyl propane-2-sulfonate
V027-5124 Screening compound: 3-{[(ethylcarbamoyl)(propan-2-yl)amino]methyl}phenyl propane-2-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-5124
3-{[(ethylcarbamoyl)(propan-2-yl)amino]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

V027-5124

Molecular Formula

C16H26N2O4S (C16 H26 N2 O4 S)

Compound Name

3-{[(ethylcarbamoyl)(propan-2-yl)amino]methyl}phenyl propane-2-sulfonate

IUPAC name

3-{[(ethylcarbamoyl)(propan-2-yl)amino]methyl}phenyl propane-2-sulfonate

SMILES

CCNC(N(Cc1cccc(OS(C(C)C)(=O)=O)c1)C(C)C)=O

InChI

InChI=1S/C16H26N2O4S/c1-6-17-16(19)18(12(2)3)11-14-8-7-9-15(10-14)22-23(20,21)13(4)5/h7-10,12-13H,6,11H2,1-5H3,(H,17,19)

InChI Key

JEKVMBWTIKIDQD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10451584

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.700

Distribution Coefficient, logD

2.700

Water Solubility, LogSw

-3.19

Polar Surface Area

62.267

Acid Dissociation Constant (pKa)

17.31

Base Dissociation Constant (pKb)

1.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.30

References: we are preparing a list of scientific research reports with V027-5124 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-5124?
Check Price and Availability of V027-5124, 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 V027-5124 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-5124
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-5124
  • 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 V027-5124 available by request