S900-0134 Screening compound: 6'-[4-(methoxymethyl)piperidine-1-carbonyl]-1',5',6',7'-tetrahydrospiro[cyclopentane-1,4'-imidazo[4,5-c]pyridine]

S900-0134 Screening compound: 6'-[4-(methoxymethyl)piperidine-1-carbonyl]-1',5',6',7'-tetrahydrospiro[cyclopentane-1,4'-imidazo[4,5-c]pyridine]
S900-0134 Screening compound: 6'-[4-(methoxymethyl)piperidine-1-carbonyl]-1',5',6',7'-tetrahydrospiro[cyclopentane-1,4'-imidazo[4,5-c]pyridine] alternative view

Chemical Structure Depiction of ChemDiv screening compound S900-0134
6'-[4-(methoxymethyl)piperidine-1-carbonyl]-1',5',6',7'-tetrahydrospiro[cyclopentane-1,4'-imidazo[4,5-c]pyridine]

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

S900-0134

Molecular Formula

C18H28N4O2 (C18 H28 N4 O2)

Compound Name

6'-[4-(methoxymethyl)piperidine-1-carbonyl]-1',5',6',7'-tetrahydrospiro[cyclopentane-1,4'-imidazo[4,5-c]pyridine]

IUPAC name

(6'S)-6'-[4-(methoxymethyl)piperidine-1-carbonyl]-1'5'6'7'-tetrahydrospiro[cyclopentane-14'-imidazo[45-c]pyridine]

SMILES

COCC(CC1)CCN1C([C@H](C1)NC2(CCCC2)c2c1[nH]cn2)=O

InChI

InChI=1S/C18H28N4O2/c1-24-11-13-4-8-22(9-5-13)17(23)15-10-14-16(20-12-19-14)18(21-15)6-2-3-7-18/h12-13,15,21H,2-11H2,1H3,(H,19,20)/t15-/m0/s1

InChI Key

DWUZGJBYWAIZQS-HNNXBMFYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.303

Distribution Coefficient, logD

-1.127

Water Solubility, LogSw

-1.67

Polar Surface Area

61.496

Acid Dissociation Constant (pKa)

14.11

Base Dissociation Constant (pKb)

9.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

77.78

S900-0134 in Drug Discovery

Included in Screening Libraries

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

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
  • Cyclic compounds
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with S900-0134 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S900-0134?
Check Price and Availability of S900-0134, 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 S900-0134 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S900-0134
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S900-0134
  • 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 S900-0134 available by request