V025-2889 Screening compound: 5-[(N-cyclopropyl-3-methylbutanamido)methyl]-2-methoxyphenyl ethane-1-sulfonate

V025-2889 Screening compound: 5-[(N-cyclopropyl-3-methylbutanamido)methyl]-2-methoxyphenyl ethane-1-sulfonate
V025-2889 Screening compound: 5-[(N-cyclopropyl-3-methylbutanamido)methyl]-2-methoxyphenyl ethane-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-2889
5-[(N-cyclopropyl-3-methylbutanamido)methyl]-2-methoxyphenyl ethane-1-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

V025-2889

Molecular Formula

C18H27NO5S (C18 H27 NO5 S)

Compound Name

5-[(N-cyclopropyl-3-methylbutanamido)methyl]-2-methoxyphenyl ethane-1-sulfonate

IUPAC name

5-[(N-cyclopropyl-3-methylbutanamido)methyl]-2-methoxyphenyl ethane-1-sulfonate

SMILES

CCS(Oc(cc(CN(C1CC1)C(CC(C)C)=O)cc1)c1OC)(=O)=O

InChI

InChI=1S/C18H27NO5S/c1-5-25(21,22)24-17-11-14(6-9-16(17)23-4)12-19(15-7-8-15)18(20)10-13(2)3/h6,9,11,13,15H,5,7-8,10,12H2,1-4H3

InChI Key

YKQSJTNNDDKDEX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19787775

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.48

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

2.779

Distribution Coefficient, logD

2.779

Water Solubility, LogSw

-3.27

Polar Surface Area

58.323

Acid Dissociation Constant (pKa)

21.62

Base Dissociation Constant (pKb)

-2.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.10

References: we are preparing a list of scientific research reports with V025-2889 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-2889?
Check Price and Availability of V025-2889, 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 V025-2889 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-2889
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-2889
  • 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 V025-2889 available by request