C703-1105 Screening compound: N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-4-methyl-4H-thieno[3,2-b]pyrrole-5-carboxamide

C703-1105 Screening compound: N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-4-methyl-4H-thieno[3,2-b]pyrrole-5-carboxamide
C703-1105 Screening compound: N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-4-methyl-4H-thieno[3,2-b]pyrrole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C703-1105
N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-4-methyl-4H-thieno[3,2-b]pyrrole-5-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

C703-1105

Molecular Formula

C22H28N4OS (C22 H28 N4 OS)

Compound Name

N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-4-methyl-4H-thieno[3,2-b]pyrrole-5-carboxamide

IUPAC name

N-{2-[4-(23-dimethylphenyl)piperazin-1-yl]ethyl}-4-methyl-4H-thieno[32-b]pyrrole-5-carboxamide

SMILES

Cc1cccc(N2CCN(CCNC(c3cc(scc4)c4n3C)=O)CC2)c1C

InChI

InChI=1S/C22H28N4OS/c1-16-5-4-6-18(17(16)2)26-12-10-25(11-13-26)9-8-23-22(27)20-15-21-19(24(20)3)7-14-28-21/h4-7,14-15H,8-13H2,1-3H3,(H,23,27)

InChI Key

CIBHIZXBAVNOLP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14786283

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.56

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.844

Distribution Coefficient, logD

3.628

Water Solubility, LogSw

-3.91

Polar Surface Area

33.989

Acid Dissociation Constant (pKa)

12.78

Base Dissociation Constant (pKb)

7.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

C703-1105 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

GPCR Targeted Library (31838 compounds)

KRAS-Targeted Library (16000 compounds)

Nucleic Acid Ligands (8311 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
  • PPI modulators
Targets:
  • GPCR
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with C703-1105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C703-1105?
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What is the minimum amount of C703-1105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C703-1105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C703-1105
  • 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 C703-1105 available by request