0467-0906 Screening compound: 3-{[2-(5-methoxy-1H-indol-3-yl)ethyl]carbamoyl}propanoic acid

0467-0906 Screening compound: 3-{[2-(5-methoxy-1H-indol-3-yl)ethyl]carbamoyl}propanoic acid
0467-0906 Screening compound: 3-{[2-(5-methoxy-1H-indol-3-yl)ethyl]carbamoyl}propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 0467-0906
3-{[2-(5-methoxy-1H-indol-3-yl)ethyl]carbamoyl}propanoic 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

0467-0906

Molecular Formula

C15H18N2O4 (C15 H18 N2 O4)

Compound Name

3-{[2-(5-methoxy-1H-indol-3-yl)ethyl]carbamoyl}propanoic acid

IUPAC name

3-{[2-(5-methoxy-1H-indol-3-yl)ethyl]carbamoyl}propanoic acid

SMILES

COc(cc1)cc2c1[nH]cc2CCNC(CCC(O)=O)=O

InChI

InChI=1S/C15H18N2O4/c1-21-11-2-3-13-12(8-11)10(9-17-13)6-7-16-14(18)4-5-15(19)20/h2-3,8-9,17H,4-7H2,1H3,(H,16,18)(H,19,20)

InChI Key

HFHMMAITWIBNLP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00411469

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.635

Distribution Coefficient, logD

-2.315

Water Solubility, LogSw

-1.89

Polar Surface Area

70.350

Acid Dissociation Constant (pKa)

4.45

Base Dissociation Constant (pKb)

4.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

0467-0906 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Arginase Targeted Library (2009 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 0467-0906 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0467-0906?
Check Price and Availability of 0467-0906, 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 0467-0906 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0467-0906
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0467-0906
  • 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 0467-0906 available by request