F066-0412 Screening compound: N-(3,4,5-TRIMETHOXYPHENYL)-2,3-DIHYDRO-1,4-BENZODIOXINE-6-CARBOXAMIDE

F066-0412 Screening compound: N-(3,4,5-TRIMETHOXYPHENYL)-2,3-DIHYDRO-1,4-BENZODIOXINE-6-CARBOXAMIDE
F066-0412 Screening compound: N-(3,4,5-TRIMETHOXYPHENYL)-2,3-DIHYDRO-1,4-BENZODIOXINE-6-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound F066-0412
N-(3,4,5-TRIMETHOXYPHENYL)-2,3-DIHYDRO-1,4-BENZODIOXINE-6-CARBOXAMIDE

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

F066-0412

Molecular Formula

C18H19NO6 (C18 H19 NO6)

Compound Name

N-(3,4,5-TRIMETHOXYPHENYL)-2,3-DIHYDRO-1,4-BENZODIOXINE-6-CARBOXAMIDE

IUPAC name

N-(345-trimethoxyphenyl)-23-dihydro-14-benzodioxine-6-carboxamide

SMILES

COc1cc(NC(c(cc2)cc3c2OCCO3)=O)cc(OC)c1OC

InChI

InChI=1S/C18H19NO6/c1-21-15-9-12(10-16(22-2)17(15)23-3)19-18(20)11-4-5-13-14(8-11)25-7-6-24-13/h4-5,8-10H,6-7H2,1-3H3,(H,19,20)

InChI Key

HUWLDXPMJHDJEF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04725680

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.463

Distribution Coefficient, logD

1.462

Water Solubility, LogSw

-2.22

Polar Surface Area

62.131

Acid Dissociation Constant (pKa)

9.84

Base Dissociation Constant (pKb)

-0.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

References: we are preparing a list of scientific research reports with F066-0412 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F066-0412?
Check Price and Availability of F066-0412, 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 F066-0412 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F066-0412
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F066-0412
  • 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 F066-0412 available by request