4534-1180 Screening compound: (Z)-[1-amino-2-(naphthalen-1-yl)ethylidene]amino 3-methoxybenzoate

4534-1180 Screening compound: (Z)-[1-amino-2-(naphthalen-1-yl)ethylidene]amino 3-methoxybenzoate
4534-1180 Screening compound: (Z)-[1-amino-2-(naphthalen-1-yl)ethylidene]amino 3-methoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4534-1180
(Z)-[1-amino-2-(naphthalen-1-yl)ethylidene]amino 3-methoxybenzoate

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

4534-1180

Molecular Formula

C20H18N2O3 (C20 H18 N2 O3)

Compound Name

(Z)-[1-amino-2-(naphthalen-1-yl)ethylidene]amino 3-methoxybenzoate

IUPAC name

(Z)-[1-amino-2-(naphthalen-1-yl)ethylidene]amino 3-methoxybenzoate

SMILES

COc1cccc(C(O/N=C(/Cc2cccc3ccccc23)\N)=O)c1

InChI

InChI=1S/C20H18N2O3/c1-24-17-10-5-9-16(12-17)20(23)25-22-19(21)13-15-8-4-7-14-6-2-3-11-18(14)15/h2-12H,13H2,1H3,(H2,21,22)

InChI Key

USBLVJQKIQEQHO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01152986

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.796

Distribution Coefficient, logD

3.796

Water Solubility, LogSw

-4.21

Polar Surface Area

59.283

Acid Dissociation Constant (pKa)

15.59

Base Dissociation Constant (pKb)

1.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

4534-1180 in Drug Discovery

Included in Screening Libraries

NOTUM (Wnt signaling) Library (3881 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4534-1180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4534-1180?
Check Price and Availability of 4534-1180, 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 4534-1180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4534-1180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4534-1180
  • 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 4534-1180 available by request