S632-4317 Screening compound: N~1~-methyl-4-{1-[(1-methyl-1H-imidazol-4-yl)carbonyl]tetrahydro-1H-pyrrol-3-yl}tetrahydro-1(2H)-pyridinecarboxamide

S632-4317 Screening compound: N~1~-methyl-4-{1-[(1-methyl-1H-imidazol-4-yl)carbonyl]tetrahydro-1H-pyrrol-3-yl}tetrahydro-1(2H)-pyridinecarboxamide
S632-4317 Screening compound: N~1~-methyl-4-{1-[(1-methyl-1H-imidazol-4-yl)carbonyl]tetrahydro-1H-pyrrol-3-yl}tetrahydro-1(2H)-pyridinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S632-4317
N~1~-methyl-4-{1-[(1-methyl-1H-imidazol-4-yl)carbonyl]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

S632-4317

Molecular Formula

C16H25N5O2 (C16 H25 N5 O2)

Compound Name

N~1~-methyl-4-{1-[(1-methyl-1H-imidazol-4-yl)carbonyl]tetrahydro-1H-pyrrol-3-yl}tetrahydro-1(2H)-pyridinecarboxamide

IUPAC name

n/a

SMILES

CNC(N(CC1)CCC1C(CC1)CN1C(c1cn(C)cn1)=O)=O

InChI

InChI=1S/C16H25N5O2/c1-17-16(23)20-6-3-12(4-7-20)13-5-8-21(9-13)15(22)14-10-19(2)11-18-14/h10-13H,3-9H2,1-2H3,(H,17,23)/t13-/m0/s1

InChI Key

MINRPAJOZJFRGP-ZDUSSCGKSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.246

Distribution Coefficient, logD

0.246

Water Solubility, LogSw

-1.63

Polar Surface Area

56.764

Acid Dissociation Constant (pKa)

16.65

Base Dissociation Constant (pKb)

2.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.75

S632-4317 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S632-4317 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S632-4317?
Check Price and Availability of S632-4317, 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 S632-4317 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S632-4317
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S632-4317
  • 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 S632-4317 available by request