S018-0560F Screening compound: 4-(pyrrolidine-1-carbonyl)-2-(thiophene-2-sulfonyl)-2-azaspiro[4.5]decane

S018-0560F Screening compound: 4-(pyrrolidine-1-carbonyl)-2-(thiophene-2-sulfonyl)-2-azaspiro[4.5]decane
S018-0560F Screening compound: 4-(pyrrolidine-1-carbonyl)-2-(thiophene-2-sulfonyl)-2-azaspiro[4.5]decane alternative view

Chemical Structure Depiction of ChemDiv screening compound S018-0560F
4-(pyrrolidine-1-carbonyl)-2-(thiophene-2-sulfonyl)-2-azaspiro[4.5]decane

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

S018-0560F

Molecular Formula

C18H26N2O3S2 (C18 H26 N2 O3 S2)

Compound Name

4-(pyrrolidine-1-carbonyl)-2-(thiophene-2-sulfonyl)-2-azaspiro[4.5]decane

IUPAC name

4-(pyrrolidine-1-carbonyl)-2-(thiophene-2-sulfonyl)-2-azaspiro[4.5]decane

SMILES

O=C(C(CN(C1)S(c2cccs2)(=O)=O)C11CCCCC1)N1CCCC1

InChI

InChI=1S/C18H26N2O3S2/c21-17(19-10-4-5-11-19)15-13-20(14-18(15)8-2-1-3-9-18)25(22,23)16-7-6-12-24-16/h6-7,12,15H,1-5,8-11,13-14H2/t15-/m0/s1

InChI Key

VKHQZWOSUMLDNF-HNNXBMFYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.622

Distribution Coefficient, logD

2.622

Water Solubility, LogSw

-2.77

Polar Surface Area

50.135

Acid Dissociation Constant (pKa)

25.66

Base Dissociation Constant (pKb)

-2.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

72.20

References: we are preparing a list of scientific research reports with S018-0560F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S018-0560F?
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What is the minimum amount of S018-0560F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S018-0560F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S018-0560F
  • 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 S018-0560F available by request