V016-7401 Screening compound: N-(butan-2-yl)-4-(prop-2-en-1-yloxy)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole-2-carboxamide

V016-7401 Screening compound: N-(butan-2-yl)-4-(prop-2-en-1-yloxy)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole-2-carboxamide
V016-7401 Screening compound: N-(butan-2-yl)-4-(prop-2-en-1-yloxy)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-7401
N-(butan-2-yl)-4-(prop-2-en-1-yloxy)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole-2-carboxamide

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

V016-7401

Molecular Formula

C24H25F3N2O2 (C24 H25 F3 N2 O2)

Compound Name

N-(butan-2-yl)-4-(prop-2-en-1-yloxy)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole-2-carboxamide

IUPAC name

N-(butan-2-yl)-4-(prop-2-en-1-yloxy)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole-2-carboxamide

SMILES

CCC(C)NC(c1cc(c(OCC=C)ccc2)c2n1Cc1ccc(C(F)(F)F)cc1)=O

InChI

InChI=1S/C24H25F3N2O2/c1-4-13-31-22-8-6-7-20-19(22)14-21(23(30)28-16(3)5-2)29(20)15-17-9-11-18(12-10-17)24(25,26)27/h4,6-12,14,16H,1,5,13,15H2,2-3H3,(H,28,30)/t16-/m0/s1

InChI Key

HXNWCHLLHIUWOA-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14247686

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.47

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.074

Distribution Coefficient, logD

6.074

Water Solubility, LogSw

-5.72

Polar Surface Area

32.323

Acid Dissociation Constant (pKa)

15.54

Base Dissociation Constant (pKb)

-0.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.20

V016-7401 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V016-7401 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-7401?
Check Price and Availability of V016-7401, 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 V016-7401 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-7401
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-7401
  • 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 V016-7401 available by request