V025-8395 Screening compound: propan-2-yl 2-[(3-{[(tert-butylcarbamoyl)(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate

V025-8395 Screening compound: propan-2-yl 2-[(3-{[(tert-butylcarbamoyl)(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate
V025-8395 Screening compound: propan-2-yl 2-[(3-{[(tert-butylcarbamoyl)(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-8395
propan-2-yl 2-[(3-{[(tert-butylcarbamoyl)(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate

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

V025-8395

Molecular Formula

C25H34N2O7S (C25 H34 N2 O7 S)

Compound Name

propan-2-yl 2-[(3-{[(tert-butylcarbamoyl)(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate

IUPAC name

propan-2-yl 2-[(3-{[(tert-butylcarbamoyl)(2-methoxyethyl)amino]methyl}phenoxy)sulfonyl]benzoate

SMILES

CC(C)OC(c(cccc1)c1S(Oc1cc(CN(CCOC)C(NC(C)(C)C)=O)ccc1)(=O)=O)=O

InChI

InChI=1S/C25H34N2O7S/c1-18(2)33-23(28)21-12-7-8-13-22(21)35(30,31)34-20-11-9-10-19(16-20)17-27(14-15-32-6)24(29)26-25(3,4)5/h7-13,16,18H,14-15,17H2,1-6H3,(H,26,29)

InChI Key

LLMWDJOXEZVSCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20498840

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.62

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.965

Distribution Coefficient, logD

3.965

Water Solubility, LogSw

-4.07

Polar Surface Area

90.203

Acid Dissociation Constant (pKa)

16.81

Base Dissociation Constant (pKb)

1.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

References: we are preparing a list of scientific research reports with V025-8395 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-8395?
Check Price and Availability of V025-8395, 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 V025-8395 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-8395
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-8395
  • 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 V025-8395 available by request