V001-7631 Screening compound: 5-{[(tert-butylcarbamoyl)(propan-2-yl)amino]methyl}-2-methoxyphenyl propane-2-sulfonate

V001-7631 Screening compound: 5-{[(tert-butylcarbamoyl)(propan-2-yl)amino]methyl}-2-methoxyphenyl propane-2-sulfonate
V001-7631 Screening compound: 5-{[(tert-butylcarbamoyl)(propan-2-yl)amino]methyl}-2-methoxyphenyl propane-2-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-7631
5-{[(tert-butylcarbamoyl)(propan-2-yl)amino]methyl}-2-methoxyphenyl 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

V001-7631

Molecular Formula

C19H32N2O5S (C19 H32 N2 O5 S)

Compound Name

5-{[(tert-butylcarbamoyl)(propan-2-yl)amino]methyl}-2-methoxyphenyl propane-2-sulfonate

IUPAC name

5-{[(tert-butylcarbamoyl)(propan-2-yl)amino]methyl}-2-methoxyphenyl propane-2-sulfonate

SMILES

CC(C)N(Cc(cc1)cc(OS(C(C)C)(=O)=O)c1OC)C(NC(C)(C)C)=O

InChI

InChI=1S/C19H32N2O5S/c1-13(2)21(18(22)20-19(5,6)7)12-15-9-10-16(25-8)17(11-15)26-27(23,24)14(3)4/h9-11,13-14H,12H2,1-8H3,(H,20,22)

InChI Key

VAZVMVGYNOGVEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19790043

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.384

Distribution Coefficient, logD

3.384

Water Solubility, LogSw

-3.82

Polar Surface Area

69.182

Acid Dissociation Constant (pKa)

17.26

Base Dissociation Constant (pKb)

3.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.20

References: we are preparing a list of scientific research reports with V001-7631 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-7631?
Check Price and Availability of V001-7631, 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 V001-7631 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-7631
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-7631
  • 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 V001-7631 available by request