V011-3621 Screening compound: 3-methyl-N~4~-(tetrahydro-2-furanylmethyl)-5-[4-(trifluoromethoxy)phenyl]-4-isoxazolecarboxamide

V011-3621 Screening compound: 3-methyl-N~4~-(tetrahydro-2-furanylmethyl)-5-[4-(trifluoromethoxy)phenyl]-4-isoxazolecarboxamide
V011-3621 Screening compound: 3-methyl-N~4~-(tetrahydro-2-furanylmethyl)-5-[4-(trifluoromethoxy)phenyl]-4-isoxazolecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-3621
3-methyl-N~4~-(tetrahydro-2-furanylmethyl)-5-[4-(trifluoromethoxy)phenyl]-4-isoxazolecarboxamide

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

V011-3621

Molecular Formula

C17H17F3N2O4 (C17 H17 F3 N2 O4)

Compound Name

3-methyl-N~4~-(tetrahydro-2-furanylmethyl)-5-[4-(trifluoromethoxy)phenyl]-4-isoxazolecarboxamide

IUPAC name

n/a

SMILES

Cc1noc(-c(cc2)ccc2OC(F)(F)F)c1C(NCC1OCCC1)=O

InChI

InChI=1S/C17H17F3N2O4/c1-10-14(16(23)21-9-13-3-2-8-24-13)15(26-22-10)11-4-6-12(7-5-11)25-17(18,19)20/h4-7,13H,2-3,8-9H2,1H3,(H,21,23)/t13-/m1/s1

InChI Key

LUHAVLZYYGAOAD-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD19959515

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.219

Distribution Coefficient, logD

3.219

Water Solubility, LogSw

-3.66

Polar Surface Area

61.588

Acid Dissociation Constant (pKa)

13.68

Base Dissociation Constant (pKb)

-1.60

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.20

V011-3621 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V011-3621 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-3621?
Check Price and Availability of V011-3621, 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 V011-3621 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-3621
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-3621
  • 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 V011-3621 available by request