2435-0154 Screening compound: 6,8-dimethyl (2Z)-5-amino-3-oxo-7-(pyridin-3-yl)-2-[(pyridin-3-yl)methylidene]-2H,3H,7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate

2435-0154 Screening compound: 6,8-dimethyl (2Z)-5-amino-3-oxo-7-(pyridin-3-yl)-2-[(pyridin-3-yl)methylidene]-2H,3H,7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
2435-0154 Screening compound: 6,8-dimethyl (2Z)-5-amino-3-oxo-7-(pyridin-3-yl)-2-[(pyridin-3-yl)methylidene]-2H,3H,7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2435-0154
6,8-dimethyl (2Z)-5-amino-3-oxo-7-(pyridin-3-yl)-2-[(pyridin-3-yl)methylidene]-2H,3H,7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate

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

2435-0154

Molecular Formula

C22H18N4O5S (C22 H18 N4 O5 S)

Compound Name

6,8-dimethyl (2Z)-5-amino-3-oxo-7-(pyridin-3-yl)-2-[(pyridin-3-yl)methylidene]-2H,3H,7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate

IUPAC name

68-dimethyl (2Z)-5-amino-3-oxo-7-(pyridin-3-yl)-2-[(pyridin-3-yl)methylidene]-2H3H7H-[13]thiazolo[32-a]pyridine-68-dicarboxylate

SMILES

COC(C(C(c1cnccc1)C(C(OC)=O)=C(N)N1C2=O)=C1S/C2=C\c1cnccc1)=O

InChI

InChI=1S/C22H18N4O5S/c1-30-21(28)16-15(13-6-4-8-25-11-13)17(22(29)31-2)20-26(18(16)23)19(27)14(32-20)9-12-5-3-7-24-10-12/h3-11,15H,23H2,1-2H3/t15-/m0/s1

InChI Key

AFRZVJRINSHQDZ-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD01875277

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.47

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.270

Distribution Coefficient, logD

1.270

Water Solubility, LogSw

-1.38

Polar Surface Area

97.673

Acid Dissociation Constant (pKa)

12.30

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.60

References: we are preparing a list of scientific research reports with 2435-0154 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2435-0154
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2435-0154
  • 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 2435-0154 available by request