C450-0655 Screening compound: 2-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonamido)-4-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pentanamide

C450-0655 Screening compound: 2-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonamido)-4-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pentanamide
C450-0655 Screening compound: 2-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonamido)-4-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C450-0655
2-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonamido)-4-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pentanamide

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

C450-0655

Molecular Formula

C24H28N4O4S2 (C24 H28 N4 O4 S2)

Compound Name

2-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonamido)-4-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pentanamide

IUPAC name

2-(1-acetyl-23-dihydro-1H-indole-5-sulfonamido)-4-methyl-N-(6-methyl-13-benzothiazol-2-yl)pentanamide

SMILES

CC(C)CC(C(Nc1nc(ccc(C)c2)c2s1)=O)NS(c(cc1)cc(CC2)c1N2C(C)=O)(=O)=O

InChI

InChI=1S/C24H28N4O4S2/c1-14(2)11-20(23(30)26-24-25-19-7-5-15(3)12-22(19)33-24)27-34(31,32)18-6-8-21-17(13-18)9-10-28(21)16(4)29/h5-8,12-14,20,27H,9-11H2,1-4H3,(H,25,26,30)/t20-/m0/s1

InChI Key

OGAHXEXPVJJCNX-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD14759458

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

500.64

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.741

Distribution Coefficient, logD

4.740

Water Solubility, LogSw

-4.38

Polar Surface Area

91.383

Acid Dissociation Constant (pKa)

10.10

Base Dissociation Constant (pKb)

-0.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

C450-0655 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C450-0655 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C450-0655?
Check Price and Availability of C450-0655, 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 C450-0655 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C450-0655
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C450-0655
  • 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 C450-0655 available by request