G242-0268 Screening compound: N-(2-ethylphenyl)-N,2,5-trimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonamide

G242-0268 Screening compound: N-(2-ethylphenyl)-N,2,5-trimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonamide
G242-0268 Screening compound: N-(2-ethylphenyl)-N,2,5-trimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G242-0268
N-(2-ethylphenyl)-N,2,5-trimethyl-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

G242-0268

Molecular Formula

C20H27N3O3S (C20 H27 N3 O3 S)

Compound Name

N-(2-ethylphenyl)-N,2,5-trimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonamide

IUPAC name

N-(2-ethylphenyl)-N25-trimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonamide

SMILES

CCc(cccc1)c1N(C)S(c1c(C)[nH]c(C)c1C(N1CCCC1)=O)(=O)=O

InChI

InChI=1S/C20H27N3O3S/c1-5-16-10-6-7-11-17(16)22(4)27(25,26)19-15(3)21-14(2)18(19)20(24)23-12-8-9-13-23/h6-7,10-11,21H,5,8-9,12-13H2,1-4H3

InChI Key

ADHPKENXOYQPAV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14989631

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.188

Distribution Coefficient, logD

3.188

Water Solubility, LogSw

-3.62

Polar Surface Area

60.561

Acid Dissociation Constant (pKa)

14.32

Base Dissociation Constant (pKb)

-4.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

G242-0268 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G242-0268 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G242-0268?
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What is the minimum amount of G242-0268 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G242-0268
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G242-0268
  • 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 G242-0268 available by request