E565-0355 Screening compound: 1-{3-[(4-isopropylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-yl}-4-piperidinecarboxamide

E565-0355 Screening compound: 1-{3-[(4-isopropylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-yl}-4-piperidinecarboxamide
E565-0355 Screening compound: 1-{3-[(4-isopropylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-yl}-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E565-0355
1-{3-[(4-isopropylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-yl}-4-piperidinecarboxamide

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

E565-0355

Molecular Formula

C22H24N6O3S2 (C22 H24 N6 O3 S2)

Compound Name

1-{3-[(4-isopropylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-yl}-4-piperidinecarboxamide

IUPAC name

1-{10-[4-(propan-2-yl)benzenesulfonyl]-5-thia-181112-tetraazatricyclo[7.3.0.0^{26}]dodeca-2(6)37911-pentaen-7-yl}piperidine-4-carboxamide

SMILES

CC(C)c(cc1)ccc1S(c(nnn1c2c3scc2)c1nc3N(CC1)CCC1C(N)=O)(=O)=O

InChI

InChI=1S/C22H24N6O3S2/c1-13(2)14-3-5-16(6-4-14)33(30,31)22-21-24-20(27-10-7-15(8-11-27)19(23)29)18-17(9-12-32-18)28(21)26-25-22/h3-6,9,12-13,15H,7-8,10-11H2,1-2H3,(H2,23,29)

InChI Key

AVIYNAXIMFSEPI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06743203

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.6

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.834

Distribution Coefficient, logD

3.834

Water Solubility, LogSw

-3.92

Polar Surface Area

100.205

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

1.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

E565-0355 in Drug Discovery

Included in Screening Libraries

GABA Library (7115 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E565-0355 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E565-0355?
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What is the minimum amount of E565-0355 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E565-0355
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E565-0355
  • 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 E565-0355 available by request