K227-0897 Screening compound: (2Z)-5-(hydroxymethyl)-8-methyl-N-(2-methylphenyl)-2-{[3-(methylsulfanyl)phenyl]imino}-2H-pyrano[2,3-c]pyridine-3-carboxamide

K227-0897 Screening compound: (2Z)-5-(hydroxymethyl)-8-methyl-N-(2-methylphenyl)-2-{[3-(methylsulfanyl)phenyl]imino}-2H-pyrano[2,3-c]pyridine-3-carboxamide
K227-0897 Screening compound: (2Z)-5-(hydroxymethyl)-8-methyl-N-(2-methylphenyl)-2-{[3-(methylsulfanyl)phenyl]imino}-2H-pyrano[2,3-c]pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K227-0897
(2Z)-5-(hydroxymethyl)-8-methyl-N-(2-methylphenyl)-2-{[3-(methylsulfanyl)phenyl]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

K227-0897

Molecular Formula

C25H23N3O3S (C25 H23 N3 O3 S)

Compound Name

(2Z)-5-(hydroxymethyl)-8-methyl-N-(2-methylphenyl)-2-{[3-(methylsulfanyl)phenyl]imino}-2H-pyrano[2,3-c]pyridine-3-carboxamide

IUPAC name

(2Z)-5-(hydroxymethyl)-8-methyl-N-(2-methylphenyl)-2-{[3-(methylsulfanyl)phenyl]imino}-2H-pyrano[23-c]pyridine-3-carboxamide

SMILES

Cc(cccc1)c1NC(C1=Cc(c(CO)cnc2C)c2O/C1=N\c1cccc(SC)c1)=O

InChI

InChI=1S/C25H23N3O3S/c1-15-7-4-5-10-22(15)28-24(30)21-12-20-17(14-29)13-26-16(2)23(20)31-25(21)27-18-8-6-9-19(11-18)32-3/h4-13,29H,14H2,1-3H3,(H,28,30)

InChI Key

XCDCBRBXTUNJGS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15083025

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.755

Distribution Coefficient, logD

3.755

Water Solubility, LogSw

-4.05

Polar Surface Area

64.852

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

1.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

References: we are preparing a list of scientific research reports with K227-0897 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K227-0897?
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What is the minimum amount of K227-0897 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K227-0897
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K227-0897
  • 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 K227-0897 available by request