S030-1919 Screening compound: METHYL 2-({[2-(2-THIENYLCARBONYL)-2-AZASPIRO[4.5]DEC-4-YL]CARBONYL}AMINO)ACETATE

S030-1919 Screening compound: METHYL 2-({[2-(2-THIENYLCARBONYL)-2-AZASPIRO[4.5]DEC-4-YL]CARBONYL}AMINO)ACETATE
S030-1919 Screening compound: METHYL 2-({[2-(2-THIENYLCARBONYL)-2-AZASPIRO[4.5]DEC-4-YL]CARBONYL}AMINO)ACETATE alternative view

Chemical Structure Depiction of ChemDiv screening compound S030-1919
METHYL 2-({[2-(2-THIENYLCARBONYL)-2-AZASPIRO[4.5]DEC-4-YL]CARBONYL}AMINO)ACETATE

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

S030-1919

Molecular Formula

C18H24N2O4S (C18 H24 N2 O4 S)

Compound Name

METHYL 2-({[2-(2-THIENYLCARBONYL)-2-AZASPIRO[4.5]DEC-4-YL]CARBONYL}AMINO)ACETATE

IUPAC name

methyl 2-{[2-(thiophene-2-carbonyl)-2-azaspiro[4.5]decan-4-yl]formamido}acetate

SMILES

COC(CNC(C(CN(C1)C(c2cccs2)=O)C11CCCCC1)=O)=O

InChI

InChI=1S/C18H24N2O4S/c1-24-15(21)10-19-16(22)13-11-20(17(23)14-6-5-9-25-14)12-18(13)7-3-2-4-8-18/h5-6,9,13H,2-4,7-8,10-12H2,1H3,(H,19,22)/t13-/m0/s1

InChI Key

PHSTUYSARJTVSV-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD27617173

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.593

Distribution Coefficient, logD

1.593

Water Solubility, LogSw

-2.41

Polar Surface Area

63.322

Acid Dissociation Constant (pKa)

12.89

Base Dissociation Constant (pKb)

-0.45

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.11

S030-1919 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Soluble Diversity Library (15920 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Peptidomimetics of Beta-Turn Motifs Library (2153 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S030-1919 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S030-1919?
Check Price and Availability of S030-1919, 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 S030-1919 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S030-1919
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S030-1919
  • 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 S030-1919 available by request