V025-5604 Screening compound: 3-({[(2-methoxyphenyl)carbamoyl](2-methylpropyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate

V025-5604 Screening compound: 3-({[(2-methoxyphenyl)carbamoyl](2-methylpropyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
V025-5604 Screening compound: 3-({[(2-methoxyphenyl)carbamoyl](2-methylpropyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-5604
3-({[(2-methoxyphenyl)carbamoyl](2-methylpropyl)amino}methyl)phenyl 4-fluorobenzene-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

V025-5604

Molecular Formula

C25H27FN2O5S (C25 H27 FN2 O5 S)

Compound Name

3-({[(2-methoxyphenyl)carbamoyl](2-methylpropyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate

IUPAC name

3-({[(2-methoxyphenyl)carbamoyl](2-methylpropyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate

SMILES

CC(C)CN(Cc1cccc(OS(c(cc2)ccc2F)(=O)=O)c1)C(Nc(cccc1)c1OC)=O

InChI

InChI=1S/C25H27FN2O5S/c1-18(2)16-28(25(29)27-23-9-4-5-10-24(23)32-3)17-19-7-6-8-21(15-19)33-34(30,31)22-13-11-20(26)12-14-22/h4-15,18H,16-17H2,1-3H3,(H,27,29)

InChI Key

SNWIGGQOEAAJCO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19747483

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.478

Distribution Coefficient, logD

5.478

Water Solubility, LogSw

-5.40

Polar Surface Area

67.964

Acid Dissociation Constant (pKa)

12.82

Base Dissociation Constant (pKb)

1.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

V025-5604 in Drug Discovery

Included in Screening Libraries

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V025-5604 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-5604?
Check Price and Availability of V025-5604, 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 V025-5604 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-5604
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-5604
  • 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 V025-5604 available by request