8012-9271 Screening compound: 3-[2-(diethylamino)ethyl]-7-hydroxy-4-methyl-2H-chromen-2-one

8012-9271 Screening compound: 3-[2-(diethylamino)ethyl]-7-hydroxy-4-methyl-2H-chromen-2-one
8012-9271 Screening compound: 3-[2-(diethylamino)ethyl]-7-hydroxy-4-methyl-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-9271
3-[2-(diethylamino)ethyl]-7-hydroxy-4-methyl-2H-chromen-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

8012-9271

Molecular Formula

C16H21NO3 (C16 H21 NO3)

Compound Name

3-[2-(diethylamino)ethyl]-7-hydroxy-4-methyl-2H-chromen-2-one

IUPAC name

3-[2-(diethylamino)ethyl]-7-hydroxy-4-methyl-2H-chromen-2-one

SMILES

CCN(CC)CCC1=C(C)c(ccc(O)c2)c2OC1=O

InChI

InChI=1S/C16H21NO3/c1-4-17(5-2)9-8-14-11(3)13-7-6-12(18)10-15(13)20-16(14)19/h6-7,10,18H,4-5,8-9H2,1-3H3

InChI Key

KKSGOOJPXBUJIA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02579195

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

275.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.747

Distribution Coefficient, logD

2.480

Water Solubility, LogSw

-2.84

Polar Surface Area

42.188

Acid Dissociation Constant (pKa)

8.56

Base Dissociation Constant (pKb)

7.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

8012-9271 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

CORONAVIRUS Library (20774 compounds)

Integrin Receptors Targeted library (1715 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 8012-9271 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-9271?
Check Price and Availability of 8012-9271, 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 8012-9271 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-9271
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-9271
  • 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 8012-9271 available by request