C915-0763 Screening compound: 3-(4-chlorophenyl)-1-(3-methoxybenzoyl)-8-(propan-2-yl)-1,4,8-triazaspiro[4.5]dec-3-ene-2-thione

C915-0763 Screening compound: 3-(4-chlorophenyl)-1-(3-methoxybenzoyl)-8-(propan-2-yl)-1,4,8-triazaspiro[4.5]dec-3-ene-2-thione
C915-0763 Screening compound: 3-(4-chlorophenyl)-1-(3-methoxybenzoyl)-8-(propan-2-yl)-1,4,8-triazaspiro[4.5]dec-3-ene-2-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound C915-0763
3-(4-chlorophenyl)-1-(3-methoxybenzoyl)-8-(propan-2-yl)-1,4,8-triazaspiro[4.5]dec-3-ene-2-thione

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

C915-0763

Molecular Formula

C24H26ClN3O2S (C24 H26 ClN3 O2 S)

Compound Name

3-(4-chlorophenyl)-1-(3-methoxybenzoyl)-8-(propan-2-yl)-1,4,8-triazaspiro[4.5]dec-3-ene-2-thione

IUPAC name

3-(4-chlorophenyl)-1-(3-methoxybenzoyl)-8-(propan-2-yl)-148-triazaspiro[4.5]dec-3-ene-2-thione

SMILES

CC(C)N(CC1)CCC1(N(C(c1cc(OC)ccc1)=O)C1=S)N=C1c(cc1)ccc1Cl

InChI

InChI=1S/C24H26ClN3O2S/c1-16(2)27-13-11-24(12-14-27)26-21(17-7-9-19(25)10-8-17)23(31)28(24)22(29)18-5-4-6-20(15-18)30-3/h4-10,15-16H,11-14H2,1-3H3

InChI Key

OGINPTSNLLBCAB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14808260

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.01

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.474

Distribution Coefficient, logD

1.348

Water Solubility, LogSw

-4.66

Polar Surface Area

35.213

Acid Dissociation Constant (pKa)

28.04

Base Dissociation Constant (pKb)

10.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

C915-0763 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with C915-0763 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C915-0763?
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What is the minimum amount of C915-0763 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C915-0763
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C915-0763
  • 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 C915-0763 available by request