D170-0239 Screening compound: 3-(2,3-dihydro-1,4-benzodioxin-2-yl)-N-(2-acetamido-5-methylphenyl)propanamide

D170-0239 Screening compound: 3-(2,3-dihydro-1,4-benzodioxin-2-yl)-N-(2-acetamido-5-methylphenyl)propanamide
D170-0239 Screening compound: 3-(2,3-dihydro-1,4-benzodioxin-2-yl)-N-(2-acetamido-5-methylphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D170-0239
3-(2,3-dihydro-1,4-benzodioxin-2-yl)-N-(2-acetamido-5-methylphenyl)propanamide

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

D170-0239

Molecular Formula

C20H22N2O4 (C20 H22 N2 O4)

Compound Name

3-(2,3-dihydro-1,4-benzodioxin-2-yl)-N-(2-acetamido-5-methylphenyl)propanamide

IUPAC name

3-(23-dihydro-14-benzodioxin-2-yl)-N-(2-acetamido-5-methylphenyl)propanamide

SMILES

CC(Nc(ccc(C)c1)c1NC(CCC1Oc(cccc2)c2OC1)=O)=O

InChI

InChI=1S/C20H22N2O4/c1-13-7-9-16(21-14(2)23)17(11-13)22-20(24)10-8-15-12-25-18-5-3-4-6-19(18)26-15/h3-7,9,11,15H,8,10,12H2,1-2H3,(H,21,23)(H,22,24)/t15-/m0/s1

InChI Key

ATKCGMRQXPTYMC-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD07640395

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.809

Distribution Coefficient, logD

1.803

Water Solubility, LogSw

-2.31

Polar Surface Area

60.662

Acid Dissociation Constant (pKa)

9.30

Base Dissociation Constant (pKb)

1.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with D170-0239 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D170-0239?
Check Price and Availability of D170-0239, 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 D170-0239 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D170-0239
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D170-0239
  • 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 D170-0239 available by request