6652-0364 Screening compound: (Z)-[amino(pyridin-4-yl)methylidene]amino 2,4,5-trimethoxybenzoate

6652-0364 Screening compound: (Z)-[amino(pyridin-4-yl)methylidene]amino 2,4,5-trimethoxybenzoate
6652-0364 Screening compound: (Z)-[amino(pyridin-4-yl)methylidene]amino 2,4,5-trimethoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6652-0364
(Z)-[amino(pyridin-4-yl)methylidene]amino 2,4,5-trimethoxybenzoate

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

6652-0364

Molecular Formula

C16H17N3O5 (C16 H17 N3 O5)

Compound Name

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

IUPAC name

(Z)-[amino(pyridin-4-yl)methylidene]amino 245-trimethoxybenzoate

SMILES

COc(cc(c(OC)c1)OC)c1C(O/N=C(/c1ccncc1)\N)=O

InChI

InChI=1S/C16H17N3O5/c1-21-12-9-14(23-3)13(22-2)8-11(12)16(20)24-19-15(17)10-4-6-18-7-5-10/h4-9H,1-3H3,(H2,17,19)

InChI Key

KSSZDYAYBICLHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04217165

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.33

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.037

Distribution Coefficient, logD

1.035

Water Solubility, LogSw

-1.63

Polar Surface Area

84.429

Acid Dissociation Constant (pKa)

12.70

Base Dissociation Constant (pKb)

5.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

References: we are preparing a list of scientific research reports with 6652-0364 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6652-0364?
Check Price and Availability of 6652-0364, 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 6652-0364 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6652-0364
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6652-0364
  • 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 6652-0364 available by request