T866-1777 Screening compound: (4-ISOBUTYLPIPERAZINO)[(3S,4R)-1-(METHYLSULFONYL)-4-(4-PYRIDYL)TETRAHYDRO-1H-PYRROL-3-YL]METHANONE

T866-1777 Screening compound: (4-ISOBUTYLPIPERAZINO)[(3S,4R)-1-(METHYLSULFONYL)-4-(4-PYRIDYL)TETRAHYDRO-1H-PYRROL-3-YL]METHANONE
T866-1777 Screening compound: (4-ISOBUTYLPIPERAZINO)[(3S,4R)-1-(METHYLSULFONYL)-4-(4-PYRIDYL)TETRAHYDRO-1H-PYRROL-3-YL]METHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound T866-1777
(4-ISOBUTYLPIPERAZINO)[(3S,4R)-1-(METHYLSULFONYL)-4-(4-PYRIDYL)TETRAHYDRO-1H-PYRROL-3-YL]METHANONE

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

T866-1777

Molecular Formula

C19H30N4O3S (C19 H30 N4 O3 S)

Compound Name

(4-ISOBUTYLPIPERAZINO)[(3S,4R)-1-(METHYLSULFONYL)-4-(4-PYRIDYL)TETRAHYDRO-1H-PYRROL-3-YL]METHANONE

IUPAC name

n/a

SMILES

CC(C)CN(CC1)CCN1C([C@@H](CN(C1)S(C)(=O)=O)[C@H]1c1ccncc1)=O

InChI

InChI=1S/C19H30N4O3S/c1-15(2)12-21-8-10-22(11-9-21)19(24)18-14-23(27(3,25)26)13-17(18)16-4-6-20-7-5-16/h4-7,15,17-18H,8-14H2,1-3H3/t17-,18+/m0/s1

InChI Key

RUYHYBAYTJDYSL-ZWKOTPCHSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.54

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.870

Distribution Coefficient, logD

0.406

Water Solubility, LogSw

-2.16

Polar Surface Area

61.563

Acid Dissociation Constant (pKa)

21.33

Base Dissociation Constant (pKb)

7.68

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

68.40

T866-1777 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Anti-HIV1 Library (19540 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Antiviral
  • Infections
  • Immune system
Targets:
  • GPCR
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T866-1777 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T866-1777?
Check Price and Availability of T866-1777, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of T866-1777 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T866-1777
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T866-1777
  • 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 T866-1777 available by request