6018-0791 Screening compound: (Z)-[amino(pyridin-2-yl)methylidene]amino 3,4,5-triethoxybenzoate

6018-0791 Screening compound: (Z)-[amino(pyridin-2-yl)methylidene]amino 3,4,5-triethoxybenzoate
6018-0791 Screening compound: (Z)-[amino(pyridin-2-yl)methylidene]amino 3,4,5-triethoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6018-0791
(Z)-[amino(pyridin-2-yl)methylidene]amino 3,4,5-triethoxybenzoate

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

6018-0791

Molecular Formula

C19H23N3O5 (C19 H23 N3 O5)

Compound Name

(Z)-[amino(pyridin-2-yl)methylidene]amino 3,4,5-triethoxybenzoate

IUPAC name

(Z)-[amino(pyridin-2-yl)methylidene]amino 345-triethoxybenzoate

SMILES

CCOc1cc(C(O/N=C(/c2ncccc2)\N)=O)cc(OCC)c1OCC

InChI

InChI=1S/C19H23N3O5/c1-4-24-15-11-13(12-16(25-5-2)17(15)26-6-3)19(23)27-22-18(20)14-9-7-8-10-21-14/h7-12H,4-6H2,1-3H3,(H2,20,22)

InChI Key

JGDGIOMUQREIHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03719391

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.937

Distribution Coefficient, logD

1.937

Water Solubility, LogSw

-2.41

Polar Surface Area

82.875

Acid Dissociation Constant (pKa)

13.28

Base Dissociation Constant (pKb)

2.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

6018-0791 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6018-0791 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6018-0791?
Check Price and Availability of 6018-0791, 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 6018-0791 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6018-0791
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6018-0791
  • 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 6018-0791 available by request