D663-0017 Screening compound: 5-{[(2-ethoxy-3-methoxyphenyl)methyl]amino}-2,3-dihydro-1H-1,3-benzodiazol-2-one

D663-0017 Screening compound: 5-{[(2-ethoxy-3-methoxyphenyl)methyl]amino}-2,3-dihydro-1H-1,3-benzodiazol-2-one
D663-0017 Screening compound: 5-{[(2-ethoxy-3-methoxyphenyl)methyl]amino}-2,3-dihydro-1H-1,3-benzodiazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D663-0017
5-{[(2-ethoxy-3-methoxyphenyl)methyl]amino}-2,3-dihydro-1H-1,3-benzodiazol-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

D663-0017

Molecular Formula

C17H19N3O3 (C17 H19 N3 O3)

Compound Name

5-{[(2-ethoxy-3-methoxyphenyl)methyl]amino}-2,3-dihydro-1H-1,3-benzodiazol-2-one

IUPAC name

5-{[(2-ethoxy-3-methoxyphenyl)methyl]amino}-23-dihydro-1H-13-benzodiazol-2-one

SMILES

CCOc1c(CNc(cc2)cc(N3)c2NC3=O)cccc1OC

InChI

InChI=1S/C17H19N3O3/c1-3-23-16-11(5-4-6-15(16)22-2)10-18-12-7-8-13-14(9-12)20-17(21)19-13/h4-9,18H,3,10H2,1-2H3,(H2,19,20,21)

InChI Key

DJNHFTALDSGOLE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07611111

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

313.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.913

Distribution Coefficient, logD

2.912

Water Solubility, LogSw

-3.36

Polar Surface Area

61.127

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

4.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

D663-0017 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anticancer Library (62698 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Cardiovascular
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D663-0017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D663-0017?
Check Price and Availability of D663-0017, 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 D663-0017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D663-0017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D663-0017
  • 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 D663-0017 available by request