E230-1003 Screening compound: 4-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-N-(propan-2-yl)butanamide

E230-1003 Screening compound: 4-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-N-(propan-2-yl)butanamide
E230-1003 Screening compound: 4-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-N-(propan-2-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E230-1003
4-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-N-(propan-2-yl)butanamide

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

E230-1003

Molecular Formula

C22H25FN2O (C22 H25 FN2 O)

Compound Name

4-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-N-(propan-2-yl)butanamide

IUPAC name

4-{1-[(4-fluorophenyl)methyl]-1H-indol-3-yl}-N-(propan-2-yl)butanamide

SMILES

CC(C)NC(CCCc1cn(Cc(cc2)ccc2F)c2c1cccc2)=O

InChI

InChI=1S/C22H25FN2O/c1-16(2)24-22(26)9-5-6-18-15-25(21-8-4-3-7-20(18)21)14-17-10-12-19(23)13-11-17/h3-4,7-8,10-13,15-16H,5-6,9,14H2,1-2H3,(H,24,26)

InChI Key

PFCHKJWFUXUMIN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14850537

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.45

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.102

Distribution Coefficient, logD

4.102

Water Solubility, LogSw

-4.12

Polar Surface Area

25.416

Acid Dissociation Constant (pKa)

14.39

Base Dissociation Constant (pKb)

0.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

E230-1003 in Drug Discovery

Included in Screening Libraries

NOTUM (Wnt signaling) Library (3881 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E230-1003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E230-1003?
Check Price and Availability of E230-1003, 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 E230-1003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E230-1003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E230-1003
  • 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 E230-1003 available by request