8004-7195 Screening compound: 2-[(1E,6E)-7-(2-hydroxyphenyl)-3,5-dioxa-2,6-diazahepta-1,6-dien-1-yl]phenol

8004-7195 Screening compound: 2-[(1E,6E)-7-(2-hydroxyphenyl)-3,5-dioxa-2,6-diazahepta-1,6-dien-1-yl]phenol
8004-7195 Screening compound: 2-[(1E,6E)-7-(2-hydroxyphenyl)-3,5-dioxa-2,6-diazahepta-1,6-dien-1-yl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-7195
2-[(1E,6E)-7-(2-hydroxyphenyl)-3,5-dioxa-2,6-diazahepta-1,6-dien-1-yl]phenol

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

8004-7195

Molecular Formula

C15H14N2O4 (C15 H14 N2 O4)

Compound Name

2-[(1E,6E)-7-(2-hydroxyphenyl)-3,5-dioxa-2,6-diazahepta-1,6-dien-1-yl]phenol

IUPAC name

2-[(1E6E)-7-(2-hydroxyphenyl)-35-dioxa-26-diazahepta-16-dien-1-yl]phenol

SMILES

Oc1c(/C=N/OCO/N=C/c(cccc2)c2O)cccc1

InChI

InChI=1S/C15H14N2O4/c18-14-7-3-1-5-12(14)9-16-20-11-21-17-10-13-6-2-4-8-15(13)19/h1-10,18-19H,11H2

InChI Key

QTNHUYNBUQKYLZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00507065

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

286.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.530

Distribution Coefficient, logD

3.529

Water Solubility, LogSw

-3.01

Polar Surface Area

68.016

Acid Dissociation Constant (pKa)

9.88

Base Dissociation Constant (pKb)

0.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

8004-7195 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8004-7195 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-7195?
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What is the minimum amount of 8004-7195 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-7195
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-7195
  • 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 8004-7195 available by request