C916-0556 Screening compound: N-(5-chloro-2-methylphenyl)-2-({8-ethyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl}sulfanyl)acetamide

C916-0556 Screening compound: N-(5-chloro-2-methylphenyl)-2-({8-ethyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl}sulfanyl)acetamide
C916-0556 Screening compound: N-(5-chloro-2-methylphenyl)-2-({8-ethyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C916-0556
N-(5-chloro-2-methylphenyl)-2-({8-ethyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl}sulfanyl)acetamide

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

C916-0556

Molecular Formula

C24H27ClN4OS (C24 H27 ClN4 OS)

Compound Name

N-(5-chloro-2-methylphenyl)-2-({8-ethyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl}sulfanyl)acetamide

IUPAC name

N-(5-chloro-2-methylphenyl)-2-({8-ethyl-3-phenyl-148-triazaspiro[4.5]deca-13-dien-2-yl}sulfanyl)acetamide

SMILES

CCN(CC1)CCC1(N=C1c2ccccc2)N=C1SCC(Nc1c(C)ccc(Cl)c1)=O

InChI

InChI=1S/C24H27ClN4OS/c1-3-29-13-11-24(12-14-29)27-22(18-7-5-4-6-8-18)23(28-24)31-16-21(30)26-20-15-19(25)10-9-17(20)2/h4-10,15H,3,11-14,16H2,1-2H3,(H,26,30)

InChI Key

VLFVOAZSPOOTAS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26967160

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.02

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.823

Distribution Coefficient, logD

1.181

Water Solubility, LogSw

-4.22

Polar Surface Area

43.069

Acid Dissociation Constant (pKa)

10.75

Base Dissociation Constant (pKb)

10.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

C916-0556 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with C916-0556 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C916-0556?
Check Price and Availability of C916-0556, 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 C916-0556 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C916-0556
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C916-0556
  • 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 C916-0556 available by request