V025-5612 Screening compound: 5-({1-cyclobutyl-N-[(oxolan-2-yl)methyl]formamido}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate

V025-5612 Screening compound: 5-({1-cyclobutyl-N-[(oxolan-2-yl)methyl]formamido}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
V025-5612 Screening compound: 5-({1-cyclobutyl-N-[(oxolan-2-yl)methyl]formamido}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-5612
5-({1-cyclobutyl-N-[(oxolan-2-yl)methyl]formamido}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-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

V025-5612

Molecular Formula

C24H27Cl2NO6S (C24 H27 Cl2 NO6 S)

Compound Name

5-({1-cyclobutyl-N-[(oxolan-2-yl)methyl]formamido}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate

IUPAC name

5-({1-cyclobutyl-N-[(oxolan-2-yl)methyl]formamido}methyl)-2-methoxyphenyl 34-dichlorobenzene-1-sulfonate

SMILES

COc(ccc(CN(CC1OCCC1)C(C1CCC1)=O)c1)c1OS(c(cc1)cc(Cl)c1Cl)(=O)=O

InChI

InChI=1S/C24H27Cl2NO6S/c1-31-22-10-7-16(12-23(22)33-34(29,30)19-8-9-20(25)21(26)13-19)14-27(15-18-6-3-11-32-18)24(28)17-4-2-5-17/h7-10,12-13,17-18H,2-6,11,14-15H2,1H3/t18-/m1/s1

InChI Key

FBKTXZGVXYVCAV-GOSISDBHSA-N

MDL Number (MFCD)

MFCD20498792

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

528.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.850

Distribution Coefficient, logD

3.850

Water Solubility, LogSw

-4.23

Polar Surface Area

68.834

Acid Dissociation Constant (pKa)

23.04

Base Dissociation Constant (pKb)

-1.80

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.80

References: we are preparing a list of scientific research reports with V025-5612 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-5612?
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What is the minimum amount of V025-5612 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-5612
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-5612
  • 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 V025-5612 available by request