7576-1269 Screening compound: ethyl 2-(4-methoxy-4-oxobutanamido)-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate

7576-1269 Screening compound: ethyl 2-(4-methoxy-4-oxobutanamido)-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate
7576-1269 Screening compound: ethyl 2-(4-methoxy-4-oxobutanamido)-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7576-1269
ethyl 2-(4-methoxy-4-oxobutanamido)-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate

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

7576-1269

Molecular Formula

C17H23NO6S (C17 H23 NO6 S)

Compound Name

ethyl 2-(4-methoxy-4-oxobutanamido)-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate

IUPAC name

ethyl 2-(4-methoxy-4-oxobutanamido)-55-dimethyl-4H5H7H-thieno[23-c]pyran-3-carboxylate

SMILES

CCOC(c1c(NC(CCC(OC)=O)=O)sc2c1CC(C)(C)OC2)=O

InChI

InChI=1S/C17H23NO6S/c1-5-23-16(21)14-10-8-17(2,3)24-9-11(10)25-15(14)18-12(19)6-7-13(20)22-4/h5-9H2,1-4H3,(H,18,19)

InChI Key

FKBZSDUNXMTHMO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01048924

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.44

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.286

Distribution Coefficient, logD

-0.130

Water Solubility, LogSw

-2.47

Polar Surface Area

72.132

Acid Dissociation Constant (pKa)

4.99

Base Dissociation Constant (pKb)

-4.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.80

References: we are preparing a list of scientific research reports with 7576-1269 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7576-1269?
Check Price and Availability of 7576-1269, 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 7576-1269 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7576-1269
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7576-1269
  • 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 7576-1269 available by request