S632-4273 Screening compound: N-METHYL-4-{1-[2-(3-THIENYL)ACETYL]TETRAHYDRO-1H-PYRROL-3-YL}TETRAHYDRO-1(2H)-PYRIDINECARBOXAMIDE

S632-4273 Screening compound: N-METHYL-4-{1-[2-(3-THIENYL)ACETYL]TETRAHYDRO-1H-PYRROL-3-YL}TETRAHYDRO-1(2H)-PYRIDINECARBOXAMIDE
S632-4273 Screening compound: N-METHYL-4-{1-[2-(3-THIENYL)ACETYL]TETRAHYDRO-1H-PYRROL-3-YL}TETRAHYDRO-1(2H)-PYRIDINECARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound S632-4273
N-METHYL-4-{1-[2-(3-THIENYL)ACETYL]TETRAHYDRO-1H-PYRROL-3-YL}TETRAHYDRO-1(2H)-PYRIDINECARBOXAMIDE

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

S632-4273

Molecular Formula

C17H25N3O2S (C17 H25 N3 O2 S)

Compound Name

N-METHYL-4-{1-[2-(3-THIENYL)ACETYL]TETRAHYDRO-1H-PYRROL-3-YL}TETRAHYDRO-1(2H)-PYRIDINECARBOXAMIDE

IUPAC name

n/a

SMILES

CNC(N(CC1)CCC1C(CC1)CN1C(Cc1cscc1)=O)=O

InChI

InChI=1S/C17H25N3O2S/c1-18-17(22)19-6-2-14(3-7-19)15-4-8-20(11-15)16(21)10-13-5-9-23-12-13/h5,9,12,14-15H,2-4,6-8,10-11H2,1H3,(H,18,22)/t15-/m1/s1

InChI Key

WBVGGPSQNOZBPN-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD29012849

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.856

Distribution Coefficient, logD

1.856

Water Solubility, LogSw

-2.29

Polar Surface Area

44.619

Acid Dissociation Constant (pKa)

16.65

Base Dissociation Constant (pKb)

2.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

64.70

S632-4273 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators

References: we are preparing a list of scientific research reports with S632-4273 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S632-4273?
Check Price and Availability of S632-4273, 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 S632-4273 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S632-4273
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S632-4273
  • 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 S632-4273 available by request