SD03-0136 Screening compound: 2-methyl-1-{3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-[2-oxo-2-(4-propylpiperazino)ethyl]-2,8-diazaspiro[4.5]dec-8-yl}-1-propanone

SD03-0136 Screening compound: 2-methyl-1-{3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-[2-oxo-2-(4-propylpiperazino)ethyl]-2,8-diazaspiro[4.5]dec-8-yl}-1-propanone
SD03-0136 Screening compound: 2-methyl-1-{3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-[2-oxo-2-(4-propylpiperazino)ethyl]-2,8-diazaspiro[4.5]dec-8-yl}-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SD03-0136
2-methyl-1-{3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-[2-oxo-2-(4-propylpiperazino)ethyl]-2,8-diazaspiro[4.5]dec-8-yl}-1-propanone

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

SD03-0136

Molecular Formula

C24H40N6O3 (C24 H40 N6 O3)

Compound Name

2-methyl-1-{3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-[2-oxo-2-(4-propylpiperazino)ethyl]-2,8-diazaspiro[4.5]dec-8-yl}-1-propanone

IUPAC name

2-methyl-1-[3-(3-methyl-124-oxadiazol-5-yl)-2-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-28-diazaspiro[4.5]decan-8-yl]propan-1-one

SMILES

CCCN(CC1)CCN1C(CN(CC(C1)(CC2)CCN2C(C(C)C)=O)C1c1nc(C)no1)=O

InChI

InChI=1S/C24H40N6O3/c1-5-8-27-11-13-28(14-12-27)21(31)16-30-17-24(15-20(30)22-25-19(4)26-33-22)6-9-29(10-7-24)23(32)18(2)3/h18,20H,5-17H2,1-4H3/t20-/m1/s1

InChI Key

BJOJVUSEOGVMBH-HXUWFJFHSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.62

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.023

Distribution Coefficient, logD

0.841

Water Solubility, LogSw

-1.15

Polar Surface Area

72.251

Acid Dissociation Constant (pKa)

22.91

Base Dissociation Constant (pKb)

7.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

83.33

SD03-0136 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SD03-0136 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD03-0136?
Check Price and Availability of SD03-0136, 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 SD03-0136 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD03-0136
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD03-0136
  • 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 SD03-0136 available by request