V030-1629 Screening compound: 5-(diethylamino)-2-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate

V030-1629 Screening compound: 5-(diethylamino)-2-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
V030-1629 Screening compound: 5-(diethylamino)-2-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-1629
5-(diethylamino)-2-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl 3-(trifluoromethyl)benzene-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

V030-1629

Molecular Formula

C28H30F4N2O5S (C28 H30 F4 N2 O5 S)

Compound Name

5-(diethylamino)-2-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate

IUPAC name

5-(diethylamino)-2-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate

SMILES

CCN(CC)c1cc(OS(c2cc(C(F)(F)F)ccc2)(=O)=O)c(CN(CCOC)C(c2cc(F)ccc2)=O)cc1

InChI

InChI=1S/C28H30F4N2O5S/c1-4-33(5-2)24-13-12-21(19-34(14-15-38-3)27(35)20-8-6-10-23(29)16-20)26(18-24)39-40(36,37)25-11-7-9-22(17-25)28(30,31)32/h6-13,16-18H,4-5,14-15,19H2,1-3H3

InChI Key

RDVPFGKVZZMDDY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20499187

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

582.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.291

Distribution Coefficient, logD

5.280

Water Solubility, LogSw

-5.43

Polar Surface Area

63.355

Acid Dissociation Constant (pKa)

27.20

Base Dissociation Constant (pKb)

5.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.10

References: we are preparing a list of scientific research reports with V030-1629 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-1629?
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What is the minimum amount of V030-1629 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-1629
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-1629
  • 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 V030-1629 available by request