4720-2051 Screening compound: 4-(4-chlorophenyl)-8-(2-methylbutan-2-yl)-1-thia-4-azaspiro[4.5]decan-3-one

4720-2051 Screening compound: 4-(4-chlorophenyl)-8-(2-methylbutan-2-yl)-1-thia-4-azaspiro[4.5]decan-3-one
4720-2051 Screening compound: 4-(4-chlorophenyl)-8-(2-methylbutan-2-yl)-1-thia-4-azaspiro[4.5]decan-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4720-2051
4-(4-chlorophenyl)-8-(2-methylbutan-2-yl)-1-thia-4-azaspiro[4.5]decan-3-one

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

4720-2051

Molecular Formula

C19H26ClNOS (C19 H26 ClNOS)

Compound Name

4-(4-chlorophenyl)-8-(2-methylbutan-2-yl)-1-thia-4-azaspiro[4.5]decan-3-one

IUPAC name

4-(4-chlorophenyl)-8-(2-methylbutan-2-yl)-1-thia-4-azaspiro[4.5]decan-3-one

SMILES

CCC(C)(C)C(CC1)CCC1(N1c(cc2)ccc2Cl)SCC1=O

InChI

InChI=1S/C19H26ClNOS/c1-4-18(2,3)14-9-11-19(12-10-14)21(17(22)13-23-19)16-7-5-15(20)6-8-16/h5-8,14H,4,9-13H2,1-3H3

InChI Key

GUJAKZJANFQTKI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02153027

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.94

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.097

Distribution Coefficient, logD

5.097

Water Solubility, LogSw

-5.26

Polar Surface Area

16.112

Acid Dissociation Constant (pKa)

16.28

Base Dissociation Constant (pKb)

-8.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.20

References: we are preparing a list of scientific research reports with 4720-2051 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4720-2051?
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What is the minimum amount of 4720-2051 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4720-2051
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4720-2051
  • 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 4720-2051 available by request