V024-9397 Screening compound: 5-(4-tert-butylbenzenesulfonamido)-N-phenyl-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole-2-carboxamide

V024-9397 Screening compound: 5-(4-tert-butylbenzenesulfonamido)-N-phenyl-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole-2-carboxamide
V024-9397 Screening compound: 5-(4-tert-butylbenzenesulfonamido)-N-phenyl-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-9397
5-(4-tert-butylbenzenesulfonamido)-N-phenyl-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

V024-9397

Molecular Formula

C33H30F3N3O3S (C33 H30 F3 N3 O3 S)

Compound Name

5-(4-tert-butylbenzenesulfonamido)-N-phenyl-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole-2-carboxamide

IUPAC name

5-(4-tert-butylbenzenesulfonamido)-N-phenyl-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indole-2-carboxamide

SMILES

CC(C)(C)c(cc1)ccc1S(Nc(cc1)cc2c1n(Cc1ccc(C(F)(F)F)cc1)c(C(Nc1ccccc1)=O)c2)(=O)=O

InChI

InChI=1S/C33H30F3N3O3S/c1-32(2,3)24-13-16-28(17-14-24)43(41,42)38-27-15-18-29-23(19-27)20-30(31(40)37-26-7-5-4-6-8-26)39(29)21-22-9-11-25(12-10-22)33(34,35)36/h4-20,38H,21H2,1-3H3,(H,37,40)

InChI Key

URABZZRWOPPIJS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19779259

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

605.68

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

8.557

Distribution Coefficient, logD

8.553

Water Solubility, LogSw

-5.87

Polar Surface Area

64.433

Acid Dissociation Constant (pKa)

9.42

Base Dissociation Constant (pKb)

-0.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

V024-9397 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V024-9397 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-9397?
Check Price and Availability of V024-9397, 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 V024-9397 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-9397
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-9397
  • 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 V024-9397 available by request