V011-3847 Screening compound: 4-{[1-(3,5-dinitrophenyl)-N-(3-methoxypropyl)formamido]methyl}phenyl methanesulfonate

V011-3847 Screening compound: 4-{[1-(3,5-dinitrophenyl)-N-(3-methoxypropyl)formamido]methyl}phenyl methanesulfonate
V011-3847 Screening compound: 4-{[1-(3,5-dinitrophenyl)-N-(3-methoxypropyl)formamido]methyl}phenyl methanesulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-3847
4-{[1-(3,5-dinitrophenyl)-N-(3-methoxypropyl)formamido]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

V011-3847

Molecular Formula

C19H21N3O9S (C19 H21 N3 O9 S)

Compound Name

4-{[1-(3,5-dinitrophenyl)-N-(3-methoxypropyl)formamido]methyl}phenyl methanesulfonate

IUPAC name

4-{[1-(35-dinitrophenyl)-N-(3-methoxypropyl)formamido]methyl}phenyl methanesulfonate

SMILES

COCCCN(Cc(cc1)ccc1OS(C)(=O)=O)C(c1cc([N+]([O-])=O)cc([N+]([O-])=O)c1)=O

InChI

InChI=1S/C19H21N3O9S/c1-30-9-3-8-20(13-14-4-6-18(7-5-14)31-32(2,28)29)19(23)15-10-16(21(24)25)12-17(11-15)22(26)27/h4-7,10-12H,3,8-9,13H2,1-2H3

InChI Key

FQDBVBSIIXYJHC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19977506

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.46

Hydrogen Bond Acceptors Count

16.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

2.142

Distribution Coefficient, logD

2.142

Water Solubility, LogSw

-2.74

Polar Surface Area

127.682

Acid Dissociation Constant (pKa)

23.98

Base Dissociation Constant (pKb)

-6.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with V011-3847 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-3847?
Check Price and Availability of V011-3847, 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 V011-3847 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-3847
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-3847
  • 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 V011-3847 available by request