1630-0719 Screening compound: 2,4-dimethyl 3-methyl-5-propanamidothiophene-2,4-dicarboxylate

1630-0719 Screening compound: 2,4-dimethyl 3-methyl-5-propanamidothiophene-2,4-dicarboxylate
1630-0719 Screening compound: 2,4-dimethyl 3-methyl-5-propanamidothiophene-2,4-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1630-0719
2,4-dimethyl 3-methyl-5-propanamidothiophene-2,4-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

1630-0719

Molecular Formula

C12H15NO5S (C12 H15 NO5 S)

Compound Name

2,4-dimethyl 3-methyl-5-propanamidothiophene-2,4-dicarboxylate

IUPAC name

24-dimethyl 3-methyl-5-propanamidothiophene-24-dicarboxylate

SMILES

CCC(Nc1c(C(OC)=O)c(C)c(C(OC)=O)s1)=O

InChI

InChI=1S/C12H15NO5S/c1-5-7(14)13-10-8(11(15)17-3)6(2)9(19-10)12(16)18-4/h5H2,1-4H3,(H,13,14)

InChI Key

MKCIVWZEJHGTDT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00426370

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

285.32

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.657

Distribution Coefficient, logD

-0.295

Water Solubility, LogSw

-2.04

Polar Surface Area

65.530

Acid Dissociation Constant (pKa)

5.45

Base Dissociation Constant (pKb)

-7.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

1630-0719 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Human GPCR Annotated Library (5539 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1630-0719 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1630-0719?
Check Price and Availability of 1630-0719, 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 1630-0719 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1630-0719
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1630-0719
  • 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 1630-0719 available by request