G243-1638 Screening compound: 4-(azepane-1-carbonyl)-N-(4-methoxyphenyl)-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide

G243-1638 Screening compound: 4-(azepane-1-carbonyl)-N-(4-methoxyphenyl)-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide
G243-1638 Screening compound: 4-(azepane-1-carbonyl)-N-(4-methoxyphenyl)-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G243-1638
4-(azepane-1-carbonyl)-N-(4-methoxyphenyl)-1,2,5-trimethyl-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

G243-1638

Molecular Formula

C21H29N3O4S (C21 H29 N3 O4 S)

Compound Name

4-(azepane-1-carbonyl)-N-(4-methoxyphenyl)-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide

IUPAC name

4-(azepane-1-carbonyl)-N-(4-methoxyphenyl)-125-trimethyl-1H-pyrrole-3-sulfonamide

SMILES

Cc1c(C(N2CCCCCC2)=O)c(S(Nc(cc2)ccc2OC)(=O)=O)c(C)n1C

InChI

InChI=1S/C21H29N3O4S/c1-15-19(21(25)24-13-7-5-6-8-14-24)20(16(2)23(15)3)29(26,27)22-17-9-11-18(28-4)12-10-17/h9-12,22H,5-8,13-14H2,1-4H3

InChI Key

PAQOVNVZSHPSLS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14990118

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.857

Distribution Coefficient, logD

2.817

Water Solubility, LogSw

-3.49

Polar Surface Area

68.190

Acid Dissociation Constant (pKa)

8.42

Base Dissociation Constant (pKb)

-1.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.60

G243-1638 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Dark Chemical Matter Library (18430 compounds)

Human GPCR Annotated Library (5539 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with G243-1638 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G243-1638?
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What is the minimum amount of G243-1638 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G243-1638
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G243-1638
  • 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 G243-1638 available by request