V025-5799 Screening compound: 4-{[(2-methylpropyl)[(propan-2-yl)carbamoyl]amino]methyl}phenyl 4-methoxybenzene-1-sulfonate

V025-5799 Screening compound: 4-{[(2-methylpropyl)[(propan-2-yl)carbamoyl]amino]methyl}phenyl 4-methoxybenzene-1-sulfonate
V025-5799 Screening compound: 4-{[(2-methylpropyl)[(propan-2-yl)carbamoyl]amino]methyl}phenyl 4-methoxybenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-5799
4-{[(2-methylpropyl)[(propan-2-yl)carbamoyl]amino]methyl}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

V025-5799

Molecular Formula

C22H30N2O5S (C22 H30 N2 O5 S)

Compound Name

4-{[(2-methylpropyl)[(propan-2-yl)carbamoyl]amino]methyl}phenyl 4-methoxybenzene-1-sulfonate

IUPAC name

4-{[(2-methylpropyl)[(propan-2-yl)carbamoyl]amino]methyl}phenyl 4-methoxybenzene-1-sulfonate

SMILES

CC(C)CN(Cc(cc1)ccc1OS(c(cc1)ccc1OC)(=O)=O)C(NC(C)C)=O

InChI

InChI=1S/C22H30N2O5S/c1-16(2)14-24(22(25)23-17(3)4)15-18-6-8-20(9-7-18)29-30(26,27)21-12-10-19(28-5)11-13-21/h6-13,16-17H,14-15H2,1-5H3,(H,23,25)

InChI Key

URDGSERQYMESHC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19794770

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.56

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

4.459

Distribution Coefficient, logD

4.459

Water Solubility, LogSw

-4.18

Polar Surface Area

69.143

Acid Dissociation Constant (pKa)

17.08

Base Dissociation Constant (pKb)

1.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

References: we are preparing a list of scientific research reports with V025-5799 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-5799?
Check Price and Availability of V025-5799, 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 V025-5799 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-5799
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-5799
  • 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 V025-5799 available by request