M435-1575 Screening compound: 2-acetyl-N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-4-hydroxy-3-methyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxamide

M435-1575 Screening compound: 2-acetyl-N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-4-hydroxy-3-methyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxamide
M435-1575 Screening compound: 2-acetyl-N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-4-hydroxy-3-methyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M435-1575
2-acetyl-N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-4-hydroxy-3-methyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-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

M435-1575

Molecular Formula

C20H16N2O7S (C20 H16 N2 O7 S)

Compound Name

2-acetyl-N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-4-hydroxy-3-methyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-carboxamide

IUPAC name

2-acetyl-N-(6-acetyl-2H-13-benzodioxol-5-yl)-4-hydroxy-3-methyl-6-oxo-6H7H-thieno[23-b]pyridine-5-carboxamide

SMILES

CC(c1c(C)c(C(O)=C(C(Nc(cc2OCOc2c2)c2C(C)=O)=O)C(N2)=O)c2s1)=O

InChI

InChI=1S/C20H16N2O7S/c1-7-14-16(25)15(19(27)22-20(14)30-17(7)9(3)24)18(26)21-11-5-13-12(28-6-29-13)4-10(11)8(2)23/h4-5H,6H2,1-3H3,(H,21,26)(H2,22,25,27)

InChI Key

GYUFZZNFXFGTPH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27541428

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.42

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.441

Distribution Coefficient, logD

-3.693

Water Solubility, LogSw

-2.46

Polar Surface Area

107.252

Acid Dissociation Constant (pKa)

2.27

Base Dissociation Constant (pKb)

-1.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

M435-1575 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with M435-1575 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M435-1575?
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What is the minimum amount of M435-1575 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M435-1575
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M435-1575
  • 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 M435-1575 available by request