2663-0001 Screening compound: methyl 4-(2,3-dihydro-1H-indol-1-yl)-4-oxobutanoate

2663-0001 Screening compound: methyl 4-(2,3-dihydro-1H-indol-1-yl)-4-oxobutanoate
2663-0001 Screening compound: methyl 4-(2,3-dihydro-1H-indol-1-yl)-4-oxobutanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2663-0001
methyl 4-(2,3-dihydro-1H-indol-1-yl)-4-oxobutanoate

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

2663-0001

Molecular Formula

C13H15NO3 (C13 H15 NO3)

Compound Name

methyl 4-(2,3-dihydro-1H-indol-1-yl)-4-oxobutanoate

IUPAC name

methyl 4-(23-dihydro-1H-indol-1-yl)-4-oxobutanoate

SMILES

COC(CCC(N(CC1)c2c1cccc2)=O)=O

InChI

InChI=1S/C13H15NO3/c1-17-13(16)7-6-12(15)14-9-8-10-4-2-3-5-11(10)14/h2-5H,6-9H2,1H3

InChI Key

AYMVNVWATJUROX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00169621

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

233.27

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.736

Distribution Coefficient, logD

1.736

Water Solubility, LogSw

-1.88

Polar Surface Area

36.240

Acid Dissociation Constant (pKa)

22.18

Base Dissociation Constant (pKb)

-0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with 2663-0001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2663-0001?
Check Price and Availability of 2663-0001, 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 2663-0001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2663-0001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2663-0001
  • 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 2663-0001 available by request