C464-0829 Screening compound: N-BENZYL-3-METHYL-2-(1-PROPANOYL-2,3-DIHYDRO-1H-INDOLE-5-SULFONAMIDO)BUTANAMIDE

C464-0829 Screening compound: N-BENZYL-3-METHYL-2-(1-PROPANOYL-2,3-DIHYDRO-1H-INDOLE-5-SULFONAMIDO)BUTANAMIDE
C464-0829 Screening compound: N-BENZYL-3-METHYL-2-(1-PROPANOYL-2,3-DIHYDRO-1H-INDOLE-5-SULFONAMIDO)BUTANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C464-0829
N-BENZYL-3-METHYL-2-(1-PROPANOYL-2,3-DIHYDRO-1H-INDOLE-5-SULFONAMIDO)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

C464-0829

Molecular Formula

C23H29N3O4S (C23 H29 N3 O4 S)

Compound Name

N-BENZYL-3-METHYL-2-(1-PROPANOYL-2,3-DIHYDRO-1H-INDOLE-5-SULFONAMIDO)BUTANAMIDE

IUPAC name

n/a

SMILES

CCC(N(CC1)c(cc2)c1cc2S(NC(C(C)C)C(NCc1ccccc1)=O)(=O)=O)=O

InChI

InChI=1S/C23H29N3O4S/c1-4-21(27)26-13-12-18-14-19(10-11-20(18)26)31(29,30)25-22(16(2)3)23(28)24-15-17-8-6-5-7-9-17/h5-11,14,16,22,25H,4,12-13,15H2,1-3H3,(H,24,28)/t22-/m0/s1

InChI Key

MUDXMQAOHXIPCA-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD14760169

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.57

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.889

Distribution Coefficient, logD

2.889

Water Solubility, LogSw

-3.60

Polar Surface Area

81.670

Acid Dissociation Constant (pKa)

10.31

Base Dissociation Constant (pKb)

-2.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

C464-0829 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-infective Library (19449 compounds)

Antiviral Annotated Library (21441 compounds)

SH2 Library (10483 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C464-0829 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C464-0829?
Check Price and Availability of C464-0829, 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 C464-0829 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C464-0829
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C464-0829
  • 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 C464-0829 available by request