6623-0903 Screening compound: (1E)-3,4,6,7,8,9-hexahydrodibenzo[b,d]furan-1(2H)-one O-[2-(4-chlorophenoxy)acetyl]oxime

6623-0903 Screening compound: (1E)-3,4,6,7,8,9-hexahydrodibenzo[b,d]furan-1(2H)-one O-[2-(4-chlorophenoxy)acetyl]oxime
6623-0903 Screening compound: (1E)-3,4,6,7,8,9-hexahydrodibenzo[b,d]furan-1(2H)-one O-[2-(4-chlorophenoxy)acetyl]oxime alternative view

Chemical Structure Depiction of ChemDiv screening compound 6623-0903
(1E)-3,4,6,7,8,9-hexahydrodibenzo[b,d]furan-1(2H)-one O-[2-(4-chlorophenoxy)acetyl]oxime

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

6623-0903

Molecular Formula

C20H20ClNO4 (C20 H20 ClNO4)

Compound Name

(1E)-3,4,6,7,8,9-hexahydrodibenzo[b,d]furan-1(2H)-one O-[2-(4-chlorophenoxy)acetyl]oxime

IUPAC name

[(3E)-8-oxatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)-dien-3-ylidene]amino 2-(4-chlorophenoxy)acetate

SMILES

O=C(COc(cc1)ccc1Cl)O/N=C(\CCC1)/c2c1oc1c2CCCC1

InChI

InChI=1S/C20H20ClNO4/c21-13-8-10-14(11-9-13)24-12-19(23)26-22-16-5-3-7-18-20(16)15-4-1-2-6-17(15)25-18/h8-11H,1-7,12H2

InChI Key

JTGWAUOFWHJCRF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02601565

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.84

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.880

Distribution Coefficient, logD

3.880

Water Solubility, LogSw

-4.87

Polar Surface Area

46.782

Acid Dissociation Constant (pKa)

22.96

Base Dissociation Constant (pKb)

1.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

6623-0903 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6623-0903 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6623-0903?
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What is the minimum amount of 6623-0903 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6623-0903
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6623-0903
  • 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 6623-0903 available by request