Y043-3837 Screening compound: 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-7,8-dimethoxy-2,3-dihydro-1H-3-benzazepin-2-one

Y043-3837 Screening compound: 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-7,8-dimethoxy-2,3-dihydro-1H-3-benzazepin-2-one
Y043-3837 Screening compound: 3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-7,8-dimethoxy-2,3-dihydro-1H-3-benzazepin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-3837
3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-7,8-dimethoxy-2,3-dihydro-1H-3-benzazepin-2-one

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

Y043-3837

Molecular Formula

C22H21NO6 (C22 H21 NO6)

Compound Name

3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-7,8-dimethoxy-2,3-dihydro-1H-3-benzazepin-2-one

IUPAC name

3-[2-(23-dihydro-14-benzodioxin-6-yl)-2-oxoethyl]-78-dimethoxy-23-dihydro-1H-3-benzazepin-2-one

SMILES

COc(c(OC)c1)cc(C2)c1C=CN(CC(c(cc1)cc3c1OCCO3)=O)C2=O

InChI

InChI=1S/C22H21NO6/c1-26-19-9-14-5-6-23(22(25)12-16(14)11-20(19)27-2)13-17(24)15-3-4-18-21(10-15)29-8-7-28-18/h3-6,9-11H,7-8,12-13H2,1-2H3

InChI Key

GXKJWRZEGFDNME-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.197

Distribution Coefficient, logD

1.197

Water Solubility, LogSw

-2.15

Polar Surface Area

60.621

Acid Dissociation Constant (pKa)

14.16

Base Dissociation Constant (pKb)

-2.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.27

References: we are preparing a list of scientific research reports with Y043-3837 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-3837?
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What is the minimum amount of Y043-3837 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-3837
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-3837
  • 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 Y043-3837 available by request