G937-0183 Screening compound: ethyl 2,5-dimethyl-4-[(4-{[4-(trifluoromethoxy)phenyl]carbamoyl}piperidin-1-yl)sulfonyl]-1H-pyrrole-3-carboxylate

G937-0183 Screening compound: ethyl 2,5-dimethyl-4-[(4-{[4-(trifluoromethoxy)phenyl]carbamoyl}piperidin-1-yl)sulfonyl]-1H-pyrrole-3-carboxylate
G937-0183 Screening compound: ethyl 2,5-dimethyl-4-[(4-{[4-(trifluoromethoxy)phenyl]carbamoyl}piperidin-1-yl)sulfonyl]-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G937-0183
ethyl 2,5-dimethyl-4-[(4-{[4-(trifluoromethoxy)phenyl]carbamoyl}piperidin-1-yl)sulfonyl]-1H-pyrrole-3-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

G937-0183

Molecular Formula

C22H26F3N3O6S (C22 H26 F3 N3 O6 S)

Compound Name

ethyl 2,5-dimethyl-4-[(4-{[4-(trifluoromethoxy)phenyl]carbamoyl}piperidin-1-yl)sulfonyl]-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 25-dimethyl-4-[(4-{[4-(trifluoromethoxy)phenyl]carbamoyl}piperidin-1-yl)sulfonyl]-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)[nH]c(C)c1S(N(CC1)CCC1C(Nc(cc1)ccc1OC(F)(F)F)=O)(=O)=O)=O

InChI

InChI=1S/C22H26F3N3O6S/c1-4-33-21(30)18-13(2)26-14(3)19(18)35(31,32)28-11-9-15(10-12-28)20(29)27-16-5-7-17(8-6-16)34-22(23,24)25/h5-8,15,26H,4,9-12H2,1-3H3,(H,27,29)

InChI Key

IJAYFODOGKXHQS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27168195

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

517.53

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.472

Distribution Coefficient, logD

3.472

Water Solubility, LogSw

-3.81

Polar Surface Area

92.519

Acid Dissociation Constant (pKa)

11.75

Base Dissociation Constant (pKb)

1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

G937-0183 in Drug Discovery

Included in Screening Libraries

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

Macl-GPIb alpha Interaction Library (22969 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G937-0183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G937-0183?
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What is the minimum amount of G937-0183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G937-0183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G937-0183
  • 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 G937-0183 available by request