C795-0924 Screening compound: 7-(4-chlorobenzyl)-N~6~-[3-(3,5-dimethylpiperidino)propyl]-6-methyl-8-oxo-5,6,7,8-tetrahydrofuro[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide

C795-0924 Screening compound: 7-(4-chlorobenzyl)-N~6~-[3-(3,5-dimethylpiperidino)propyl]-6-methyl-8-oxo-5,6,7,8-tetrahydrofuro[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide
C795-0924 Screening compound: 7-(4-chlorobenzyl)-N~6~-[3-(3,5-dimethylpiperidino)propyl]-6-methyl-8-oxo-5,6,7,8-tetrahydrofuro[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C795-0924
7-(4-chlorobenzyl)-N~6~-[3-(3,5-dimethylpiperidino)propyl]-6-methyl-8-oxo-5,6,7,8-tetrahydrofuro[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide

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

C795-0924

Molecular Formula

C28H35ClN4O3 (C28 H35 ClN4 O3)

Compound Name

7-(4-chlorobenzyl)-N~6~-[3-(3,5-dimethylpiperidino)propyl]-6-methyl-8-oxo-5,6,7,8-tetrahydrofuro[2',3':4,5]pyrrolo[1,2-a]pyrazine-6-carboxamide

IUPAC name

10-[(4-chlorophenyl)methyl]-N-[3-(35-dimethylpiperidin-1-yl)propyl]-11-methyl-9-oxo-5-oxa-110-diazatricyclo[6.4.0.0^{26}]dodeca-2(6)37-triene-11-carboxamide

SMILES

CC1CN(CCCNC(C(C)(Cn2c3cc4c2cco4)N(Cc(cc2)ccc2Cl)C3=O)=O)CC(C)C1

InChI

InChI=1S/C28H35ClN4O3/c1-19-13-20(2)16-31(15-19)11-4-10-30-27(35)28(3)18-32-23-9-12-36-25(23)14-24(32)26(34)33(28)17-21-5-7-22(29)8-6-21/h5-9,12,14,19-20H,4,10-11,13,15-18H2,1-3H3,(H,30,35)

InChI Key

VEFCTODYUJSSDH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14797136

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

511.06

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.748

Distribution Coefficient, logD

2.143

Water Solubility, LogSw

-4.69

Polar Surface Area

53.174

Acid Dissociation Constant (pKa)

14.57

Base Dissociation Constant (pKb)

10.00

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

50.00

C795-0924 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

Cyclic Ugi PPI Library (9586 compounds)

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • PPI modulators
Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with C795-0924 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C795-0924?
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What is the minimum amount of C795-0924 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C795-0924
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C795-0924
  • 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 C795-0924 available by request