G793-0196 Screening compound: ethyl 4-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamoyl]ethyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

G793-0196 Screening compound: ethyl 4-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamoyl]ethyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
G793-0196 Screening compound: ethyl 4-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamoyl]ethyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G793-0196
ethyl 4-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamoyl]ethyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

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

G793-0196

Molecular Formula

C23H28N4O4 (C23 H28 N4 O4)

Compound Name

ethyl 4-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamoyl]ethyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 4-{2-[(15-dimethyl-3-oxo-2-phenyl-23-dihydro-1H-pyrazol-4-yl)carbamoyl]ethyl}-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

CCOC(c1c(C)c(CCC(NC(C2=O)=C(C)N(C)N2c2ccccc2)=O)c(C)[nH]1)=O

InChI

InChI=1S/C23H28N4O4/c1-6-31-23(30)20-14(2)18(15(3)24-20)12-13-19(28)25-21-16(4)26(5)27(22(21)29)17-10-8-7-9-11-17/h7-11,24H,6,12-13H2,1-5H3,(H,25,28)

InChI Key

VGCJEJFYFLFXKK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27158974

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.814

Distribution Coefficient, logD

1.699

Water Solubility, LogSw

-1.97

Polar Surface Area

75.233

Acid Dissociation Constant (pKa)

7.92

Base Dissociation Constant (pKb)

-6.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

G793-0196 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G793-0196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G793-0196?
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What is the minimum amount of G793-0196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G793-0196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G793-0196
  • 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 G793-0196 available by request