V025-1048 Screening compound: 2-{[1-cyclobutyl-N-(2-methylpropyl)formamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate

V025-1048 Screening compound: 2-{[1-cyclobutyl-N-(2-methylpropyl)formamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate
V025-1048 Screening compound: 2-{[1-cyclobutyl-N-(2-methylpropyl)formamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-1048
2-{[1-cyclobutyl-N-(2-methylpropyl)formamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-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

V025-1048

Molecular Formula

C27H38N2O5S (C27 H38 N2 O5 S)

Compound Name

2-{[1-cyclobutyl-N-(2-methylpropyl)formamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate

IUPAC name

2-{[1-cyclobutyl-N-(2-methylpropyl)formamido]methyl}-5-(diethylamino)phenyl 4-methoxybenzene-1-sulfonate

SMILES

CCN(CC)c1cc(OS(c(cc2)ccc2OC)(=O)=O)c(CN(CC(C)C)C(C2CCC2)=O)cc1

InChI

InChI=1S/C27H38N2O5S/c1-6-28(7-2)23-12-11-22(19-29(18-20(3)4)27(30)21-9-8-10-21)26(17-23)34-35(31,32)25-15-13-24(33-5)14-16-25/h11-17,20-21H,6-10,18-19H2,1-5H3

InChI Key

MZKOJYQPWGEIKU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19787796

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

502.68

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.169

Distribution Coefficient, logD

5.159

Water Solubility, LogSw

-5.03

Polar Surface Area

63.101

Acid Dissociation Constant (pKa)

23.04

Base Dissociation Constant (pKb)

5.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

51.90

References: we are preparing a list of scientific research reports with V025-1048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-1048?
Check Price and Availability of V025-1048, 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 V025-1048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-1048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-1048
  • 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 V025-1048 available by request