G242-0171 Screening compound: N-benzyl-2,5-dimethyl-N-(2-phenylethyl)-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonamide

G242-0171 Screening compound: N-benzyl-2,5-dimethyl-N-(2-phenylethyl)-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonamide
G242-0171 Screening compound: N-benzyl-2,5-dimethyl-N-(2-phenylethyl)-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G242-0171
N-benzyl-2,5-dimethyl-N-(2-phenylethyl)-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonamide

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

G242-0171

Molecular Formula

C26H31N3O3S (C26 H31 N3 O3 S)

Compound Name

N-benzyl-2,5-dimethyl-N-(2-phenylethyl)-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonamide

IUPAC name

N-benzyl-25-dimethyl-N-(2-phenylethyl)-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonamide

SMILES

Cc1c(C(N2CCCC2)=O)c(S(N(CCc2ccccc2)Cc2ccccc2)(=O)=O)c(C)[nH]1

InChI

InChI=1S/C26H31N3O3S/c1-20-24(26(30)28-16-9-10-17-28)25(21(2)27-20)33(31,32)29(19-23-13-7-4-8-14-23)18-15-22-11-5-3-6-12-22/h3-8,11-14,27H,9-10,15-19H2,1-2H3

InChI Key

DMGUKQNFIWGYFW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14989604

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.133

Distribution Coefficient, logD

4.133

Water Solubility, LogSw

-4.25

Polar Surface Area

59.123

Acid Dissociation Constant (pKa)

14.34

Base Dissociation Constant (pKb)

-0.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

G242-0171 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G242-0171 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G242-0171?
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What is the minimum amount of G242-0171 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G242-0171
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G242-0171
  • 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 G242-0171 available by request