D170-0236 Screening compound: N-{4-[3-(2,3-dihydro-1,4-benzodioxin-2-yl)propanamido]-2-methylphenyl}benzamide

D170-0236 Screening compound: N-{4-[3-(2,3-dihydro-1,4-benzodioxin-2-yl)propanamido]-2-methylphenyl}benzamide
D170-0236 Screening compound: N-{4-[3-(2,3-dihydro-1,4-benzodioxin-2-yl)propanamido]-2-methylphenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D170-0236
N-{4-[3-(2,3-dihydro-1,4-benzodioxin-2-yl)propanamido]-2-methylphenyl}benzamide

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

D170-0236

Molecular Formula

C25H24N2O4 (C25 H24 N2 O4)

Compound Name

N-{4-[3-(2,3-dihydro-1,4-benzodioxin-2-yl)propanamido]-2-methylphenyl}benzamide

IUPAC name

N-{4-[3-(23-dihydro-14-benzodioxin-2-yl)propanamido]-2-methylphenyl}benzamide

SMILES

Cc(cc(cc1)NC(CCC2Oc(cccc3)c3OC2)=O)c1NC(c1ccccc1)=O

InChI

InChI=1S/C25H24N2O4/c1-17-15-19(11-13-21(17)27-25(29)18-7-3-2-4-8-18)26-24(28)14-12-20-16-30-22-9-5-6-10-23(22)31-20/h2-11,13,15,20H,12,14,16H2,1H3,(H,26,28)(H,27,29)/t20-/m0/s1

InChI Key

YCVHHRGTXWYBGV-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD07639093

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.958

Distribution Coefficient, logD

3.957

Water Solubility, LogSw

-4.08

Polar Surface Area

61.189

Acid Dissociation Constant (pKa)

10.86

Base Dissociation Constant (pKb)

2.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with D170-0236 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D170-0236?
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What is the minimum amount of D170-0236 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D170-0236
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D170-0236
  • 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 D170-0236 available by request