K227-0776 Screening compound: (2Z)-N-(2-chlorophenyl)-5-(hydroxymethyl)-8-methyl-2-[(4-phenoxyphenyl)imino]-2H-pyrano[2,3-c]pyridine-3-carboxamide

K227-0776 Screening compound: (2Z)-N-(2-chlorophenyl)-5-(hydroxymethyl)-8-methyl-2-[(4-phenoxyphenyl)imino]-2H-pyrano[2,3-c]pyridine-3-carboxamide
K227-0776 Screening compound: (2Z)-N-(2-chlorophenyl)-5-(hydroxymethyl)-8-methyl-2-[(4-phenoxyphenyl)imino]-2H-pyrano[2,3-c]pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K227-0776
(2Z)-N-(2-chlorophenyl)-5-(hydroxymethyl)-8-methyl-2-[(4-phenoxyphenyl)imino]-2H-pyrano[2,3-c]pyridine-3-carboxamide

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

K227-0776

Molecular Formula

C29H22ClN3O4 (C29 H22 ClN3 O4)

Compound Name

(2Z)-N-(2-chlorophenyl)-5-(hydroxymethyl)-8-methyl-2-[(4-phenoxyphenyl)imino]-2H-pyrano[2,3-c]pyridine-3-carboxamide

IUPAC name

(2Z)-N-(2-chlorophenyl)-5-(hydroxymethyl)-8-methyl-2-[(4-phenoxyphenyl)imino]-2H-pyrano[23-c]pyridine-3-carboxamide

SMILES

Cc1ncc(CO)c(C=C2C(Nc(cccc3)c3Cl)=O)c1O/C2=N\c(cc1)ccc1Oc1ccccc1

InChI

InChI=1S/C29H22ClN3O4/c1-18-27-23(19(17-34)16-31-18)15-24(28(35)33-26-10-6-5-9-25(26)30)29(37-27)32-20-11-13-22(14-12-20)36-21-7-3-2-4-8-21/h2-16,34H,17H2,1H3,(H,33,35)

InChI Key

XCPUBPSZAUNDIQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15082922

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

511.96

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.093

Distribution Coefficient, logD

5.092

Water Solubility, LogSw

-5.15

Polar Surface Area

71.600

Acid Dissociation Constant (pKa)

9.95

Base Dissociation Constant (pKb)

2.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.90

References: we are preparing a list of scientific research reports with K227-0776 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K227-0776?
Check Price and Availability of K227-0776, 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 K227-0776 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K227-0776
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K227-0776
  • 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 K227-0776 available by request