8018-2279 Screening compound: N~1~-[7-(3-iodobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-4-methoxybenzamide

8018-2279 Screening compound: N~1~-[7-(3-iodobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-4-methoxybenzamide
8018-2279 Screening compound: N~1~-[7-(3-iodobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-4-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-2279
N~1~-[7-(3-iodobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-4-methoxybenzamide

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

8018-2279

Molecular Formula

C23H18INO5 (C23 H18 INO5)

Compound Name

N~1~-[7-(3-iodobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-4-methoxybenzamide

IUPAC name

n/a

SMILES

COc(cc1)ccc1C(Nc(cc1OCCOc1c1)c1C(c1cccc(I)c1)=O)=O

InChI

InChI=1S/C23H18INO5/c1-28-17-7-5-14(6-8-17)23(27)25-19-13-21-20(29-9-10-30-21)12-18(19)22(26)15-3-2-4-16(24)11-15/h2-8,11-13H,9-10H2,1H3,(H,25,27)

InChI Key

RPQXMIYQBRFVAX-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

515.3

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.250

Distribution Coefficient, logD

4.223

Water Solubility, LogSw

-4.37

Polar Surface Area

59.466

Acid Dissociation Constant (pKa)

8.60

Base Dissociation Constant (pKb)

-3.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

References: we are preparing a list of scientific research reports with 8018-2279 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-2279?
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What is the minimum amount of 8018-2279 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-2279
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-2279
  • 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 8018-2279 available by request