6049-2248 Screening compound: 4-{[3-(methoxycarbonyl)-5-propylthiophen-2-yl]carbamoyl}butanoic acid

6049-2248 Screening compound: 4-{[3-(methoxycarbonyl)-5-propylthiophen-2-yl]carbamoyl}butanoic acid
6049-2248 Screening compound: 4-{[3-(methoxycarbonyl)-5-propylthiophen-2-yl]carbamoyl}butanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 6049-2248
4-{[3-(methoxycarbonyl)-5-propylthiophen-2-yl]carbamoyl}butanoic acid

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

6049-2248

Molecular Formula

C14H19NO5S (C14 H19 NO5 S)

Compound Name

4-{[3-(methoxycarbonyl)-5-propylthiophen-2-yl]carbamoyl}butanoic acid

IUPAC name

4-{[3-(methoxycarbonyl)-5-propylthiophen-2-yl]carbamoyl}butanoic acid

SMILES

CCCc1cc(C(OC)=O)c(NC(CCCC(O)=O)=O)s1

InChI

InChI=1S/C14H19NO5S/c1-3-5-9-8-10(14(19)20-2)13(21-9)15-11(16)6-4-7-12(17)18/h8H,3-7H2,1-2H3,(H,15,16)(H,17,18)

InChI Key

GTESDMIZCAGQAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02176020

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

313.37

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.788

Distribution Coefficient, logD

-0.810

Water Solubility, LogSw

-2.43

Polar Surface Area

72.740

Acid Dissociation Constant (pKa)

4.80

Base Dissociation Constant (pKb)

-5.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

6049-2248 in Drug Discovery

Included in Screening Libraries

Arginase Targeted Library (2009 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
Targets:
  • Others

References: we are preparing a list of scientific research reports with 6049-2248 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6049-2248?
Check Price and Availability of 6049-2248, 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 6049-2248 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6049-2248
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6049-2248
  • 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 6049-2248 available by request