V003-1885 Screening compound: 4-({N-[(furan-2-yl)methyl]-3,5,5-trimethylhexanamido}methyl)phenyl methanesulfonate

V003-1885 Screening compound: 4-({N-[(furan-2-yl)methyl]-3,5,5-trimethylhexanamido}methyl)phenyl methanesulfonate
V003-1885 Screening compound: 4-({N-[(furan-2-yl)methyl]-3,5,5-trimethylhexanamido}methyl)phenyl methanesulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-1885
4-({N-[(furan-2-yl)methyl]-3,5,5-trimethylhexanamido}methyl)phenyl methanesulfonate

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

V003-1885

Molecular Formula

C22H31NO5S (C22 H31 NO5 S)

Compound Name

4-({N-[(furan-2-yl)methyl]-3,5,5-trimethylhexanamido}methyl)phenyl methanesulfonate

IUPAC name

4-({N-[(furan-2-yl)methyl]-355-trimethylhexanamido}methyl)phenyl methanesulfonate

SMILES

CC(CC(C)(C)C)CC(N(Cc1ccco1)Cc(cc1)ccc1OS(C)(=O)=O)=O

InChI

InChI=1S/C22H31NO5S/c1-17(14-22(2,3)4)13-21(24)23(16-20-7-6-12-27-20)15-18-8-10-19(11-9-18)28-29(5,25)26/h6-12,17H,13-16H2,1-5H3/t17-/m1/s1

InChI Key

PRNNFVYXXLUOMZ-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD19752198

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.318

Distribution Coefficient, logD

4.318

Water Solubility, LogSw

-4.18

Polar Surface Area

59.820

Acid Dissociation Constant (pKa)

23.98

Base Dissociation Constant (pKb)

-4.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with V003-1885 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-1885?
Check Price and Availability of V003-1885, 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 V003-1885 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-1885
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-1885
  • 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 V003-1885 available by request