G636-1329 Screening compound: 1-(4-fluorophenyl)-4-{1-methyl-4-[(4-methylpiperidin-1-yl)sulfonyl]-1H-pyrrole-2-carbonyl}piperazine

G636-1329 Screening compound: 1-(4-fluorophenyl)-4-{1-methyl-4-[(4-methylpiperidin-1-yl)sulfonyl]-1H-pyrrole-2-carbonyl}piperazine
G636-1329 Screening compound: 1-(4-fluorophenyl)-4-{1-methyl-4-[(4-methylpiperidin-1-yl)sulfonyl]-1H-pyrrole-2-carbonyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound G636-1329
1-(4-fluorophenyl)-4-{1-methyl-4-[(4-methylpiperidin-1-yl)sulfonyl]-1H-pyrrole-2-carbonyl}piperazine

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

G636-1329

Molecular Formula

C22H29FN4O3S (C22 H29 FN4 O3 S)

Compound Name

1-(4-fluorophenyl)-4-{1-methyl-4-[(4-methylpiperidin-1-yl)sulfonyl]-1H-pyrrole-2-carbonyl}piperazine

IUPAC name

1-(4-fluorophenyl)-4-{1-methyl-4-[(4-methylpiperidin-1-yl)sulfonyl]-1H-pyrrole-2-carbonyl}piperazine

SMILES

CC(CC1)CCN1S(c1cn(C)c(C(N(CC2)CCN2c(cc2)ccc2F)=O)c1)(=O)=O

InChI

InChI=1S/C22H29FN4O3S/c1-17-7-9-27(10-8-17)31(29,30)20-15-21(24(2)16-20)22(28)26-13-11-25(12-14-26)19-5-3-18(23)4-6-19/h3-6,15-17H,7-14H2,1-2H3

InChI Key

ILEKDJWLZVQQRS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27147088

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.827

Distribution Coefficient, logD

2.827

Water Solubility, LogSw

-3.29

Polar Surface Area

54.168

Acid Dissociation Constant (pKa)

26.32

Base Dissociation Constant (pKb)

5.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

G636-1329 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G636-1329 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G636-1329?
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What is the minimum amount of G636-1329 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G636-1329
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G636-1329
  • 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 G636-1329 available by request