D146-0366 Screening compound: 2-{3-tert-butyl-4,9-dimethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl}-N-[(furan-2-yl)methyl]acetamide

D146-0366 Screening compound: 2-{3-tert-butyl-4,9-dimethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl}-N-[(furan-2-yl)methyl]acetamide
D146-0366 Screening compound: 2-{3-tert-butyl-4,9-dimethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl}-N-[(furan-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D146-0366
2-{3-tert-butyl-4,9-dimethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl}-N-[(furan-2-yl)methyl]acetamide

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

D146-0366

Molecular Formula

C24H25NO5 (C24 H25 NO5)

Compound Name

2-{3-tert-butyl-4,9-dimethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl}-N-[(furan-2-yl)methyl]acetamide

IUPAC name

2-{3-tert-butyl-49-dimethyl-7-oxo-7H-furo[23-f]chromen-8-yl}-N-[(furan-2-yl)methyl]acetamide

SMILES

CC(C)(C)c1coc2c1c(C)cc(O1)c2C(C)=C(CC(NCc2ccco2)=O)C1=O

InChI

InChI=1S/C24H25NO5/c1-13-9-18-21(22-20(13)17(12-29-22)24(3,4)5)14(2)16(23(27)30-18)10-19(26)25-11-15-7-6-8-28-15/h6-9,12H,10-11H2,1-5H3,(H,25,26)

InChI Key

NVOYNTKWEFDOTR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06440084

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.47

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

4.796

Distribution Coefficient, logD

4.796

Water Solubility, LogSw

-4.89

Polar Surface Area

62.901

Acid Dissociation Constant (pKa)

13.05

Base Dissociation Constant (pKb)

-1.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

D146-0366 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D146-0366 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D146-0366?
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What is the minimum amount of D146-0366 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D146-0366
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D146-0366
  • 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 D146-0366 available by request