C451-0266 Screening compound: (2E)-2-{[3-methoxy-4-(pentyloxy)phenyl]methylidene}-6-[(4-methylphenyl)methyl]-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

C451-0266 Screening compound: (2E)-2-{[3-methoxy-4-(pentyloxy)phenyl]methylidene}-6-[(4-methylphenyl)methyl]-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione
C451-0266 Screening compound: (2E)-2-{[3-methoxy-4-(pentyloxy)phenyl]methylidene}-6-[(4-methylphenyl)methyl]-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C451-0266
(2E)-2-{[3-methoxy-4-(pentyloxy)phenyl]methylidene}-6-[(4-methylphenyl)methyl]-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

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

C451-0266

Molecular Formula

C26H27N3O4S (C26 H27 N3 O4 S)

Compound Name

(2E)-2-{[3-methoxy-4-(pentyloxy)phenyl]methylidene}-6-[(4-methylphenyl)methyl]-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

IUPAC name

(2E)-2-{[3-methoxy-4-(pentyloxy)phenyl]methylidene}-6-[(4-methylphenyl)methyl]-2H3H7H-[13]thiazolo[32-b][124]triazine-37-dione

SMILES

CCCCCOc(ccc(/C=C(\C(N1N=C2Cc3ccc(C)cc3)=O)/SC1=NC2=O)c1)c1OC

InChI

InChI=1S/C26H27N3O4S/c1-4-5-6-13-33-21-12-11-19(15-22(21)32-3)16-23-25(31)29-26(34-23)27-24(30)20(28-29)14-18-9-7-17(2)8-10-18/h7-12,15-16H,4-6,13-14H2,1-3H3

InChI Key

ADVBMKRSYNIMBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06290993

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.58

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.180

Distribution Coefficient, logD

5.180

Water Solubility, LogSw

-4.82

Polar Surface Area

65.687

Acid Dissociation Constant (pKa)

21.46

Base Dissociation Constant (pKb)

-0.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

References: we are preparing a list of scientific research reports with C451-0266 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C451-0266?
Check Price and Availability of C451-0266, 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 C451-0266 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C451-0266
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C451-0266
  • 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 C451-0266 available by request