Y030-8814 Screening compound: 4-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]phenyl acetate

Y030-8814 Screening compound: 4-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]phenyl acetate
Y030-8814 Screening compound: 4-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]phenyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-8814
4-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]phenyl acetate

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

Y030-8814

Molecular Formula

C17H15NO5 (C17 H15 NO5)

Compound Name

4-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]phenyl acetate

IUPAC name

4-[(23-dihydro-14-benzodioxin-6-yl)carbamoyl]phenyl acetate

SMILES

CC(Oc(cc1)ccc1C(Nc(cc1)cc2c1OCCO2)=O)=O

InChI

InChI=1S/C17H15NO5/c1-11(19)23-14-5-2-12(3-6-14)17(20)18-13-4-7-15-16(10-13)22-9-8-21-15/h2-7,10H,8-9H2,1H3,(H,18,20)

InChI Key

HSKVYHFMXRSQHR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03929944

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

313.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.473

Distribution Coefficient, logD

1.472

Water Solubility, LogSw

-2.19

Polar Surface Area

59.904

Acid Dissociation Constant (pKa)

10.21

Base Dissociation Constant (pKb)

-1.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

Y030-8814 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

CNS targets activity set (6557 compounds)

Human Receptors Annotated Library (5376 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with Y030-8814 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-8814?
Check Price and Availability of Y030-8814, 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 Y030-8814 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-8814
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-8814
  • 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 Y030-8814 available by request