C916-0222 Screening compound: N-(4-ethylphenyl)-2-{[8-methyl-3-(4-methylphenyl)-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide

C916-0222 Screening compound: N-(4-ethylphenyl)-2-{[8-methyl-3-(4-methylphenyl)-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
C916-0222 Screening compound: N-(4-ethylphenyl)-2-{[8-methyl-3-(4-methylphenyl)-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C916-0222
N-(4-ethylphenyl)-2-{[8-methyl-3-(4-methylphenyl)-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

C916-0222

Molecular Formula

C25H30N4OS (C25 H30 N4 OS)

Compound Name

N-(4-ethylphenyl)-2-{[8-methyl-3-(4-methylphenyl)-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide

IUPAC name

N-(4-ethylphenyl)-2-{[8-methyl-3-(4-methylphenyl)-148-triazaspiro[4.5]deca-13-dien-2-yl]sulfanyl}acetamide

SMILES

CCc(cc1)ccc1NC(CSC1=NC2(CCN(C)CC2)N=C1c1ccc(C)cc1)=O

InChI

InChI=1S/C25H30N4OS/c1-4-19-7-11-21(12-8-19)26-22(30)17-31-24-23(20-9-5-18(2)6-10-20)27-25(28-24)13-15-29(3)16-14-25/h5-12H,4,13-17H2,1-3H3,(H,26,30)

InChI Key

UXTYHXTVWPPXRX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26967059

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.61

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

4.165

Distribution Coefficient, logD

1.677

Water Solubility, LogSw

-3.97

Polar Surface Area

43.707

Acid Dissociation Constant (pKa)

12.74

Base Dissociation Constant (pKb)

9.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

C916-0222 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with C916-0222 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C916-0222?
Check Price and Availability of C916-0222, 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 C916-0222 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C916-0222
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C916-0222
  • 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 C916-0222 available by request