M435-1612 Screening compound: methyl 3-{2-acetyl-4-hydroxy-3-methyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-amido}benzoate

M435-1612 Screening compound: methyl 3-{2-acetyl-4-hydroxy-3-methyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-amido}benzoate
M435-1612 Screening compound: methyl 3-{2-acetyl-4-hydroxy-3-methyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-amido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound M435-1612
methyl 3-{2-acetyl-4-hydroxy-3-methyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-amido}benzoate

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

M435-1612

Molecular Formula

C19H16N2O6S (C19 H16 N2 O6 S)

Compound Name

methyl 3-{2-acetyl-4-hydroxy-3-methyl-6-oxo-6H,7H-thieno[2,3-b]pyridine-5-amido}benzoate

IUPAC name

methyl 3-{2-acetyl-4-hydroxy-3-methyl-6-oxo-6H7H-thieno[23-b]pyridine-5-amido}benzoate

SMILES

CC(c1c(C)c(C(O)=C(C(Nc2cc(C(OC)=O)ccc2)=O)C(N2)=O)c2s1)=O

InChI

InChI=1S/C19H16N2O6S/c1-8-12-14(23)13(17(25)21-18(12)28-15(8)9(2)22)16(24)20-11-6-4-5-10(7-11)19(26)27-3/h4-7H,1-3H3,(H,20,24)(H2,21,23,25)

InChI Key

XRMCDPCJEDYMSM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27541430

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.41

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.088

Distribution Coefficient, logD

-3.046

Water Solubility, LogSw

-2.89

Polar Surface Area

98.181

Acid Dissociation Constant (pKa)

2.27

Base Dissociation Constant (pKb)

-2.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with M435-1612 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M435-1612?
Check Price and Availability of M435-1612, 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 M435-1612 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M435-1612
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M435-1612
  • 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 M435-1612 available by request