SD03-0954 Screening compound: 1-{2-[8-isobutyryl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2,8-diazaspiro[4.5]dec-2-yl]acetyl}-4-piperidinecarboxamide

SD03-0954 Screening compound: 1-{2-[8-isobutyryl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2,8-diazaspiro[4.5]dec-2-yl]acetyl}-4-piperidinecarboxamide
SD03-0954 Screening compound: 1-{2-[8-isobutyryl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2,8-diazaspiro[4.5]dec-2-yl]acetyl}-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SD03-0954
1-{2-[8-isobutyryl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2,8-diazaspiro[4.5]dec-2-yl]acetyl}-4-piperidinecarboxamide

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

SD03-0954

Molecular Formula

C23H36N6O4 (C23 H36 N6 O4)

Compound Name

1-{2-[8-isobutyryl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2,8-diazaspiro[4.5]dec-2-yl]acetyl}-4-piperidinecarboxamide

IUPAC name

1-{2-[3-(3-methyl-124-oxadiazol-5-yl)-8-(2-methylpropanoyl)-28-diazaspiro[4.5]decan-2-yl]acetyl}piperidine-4-carboxamide

SMILES

CC(C)C(N1CCC(C2)(CN(CC(N(CC3)CCC3C(N)=O)=O)C2c2nc(C)no2)CC1)=O

InChI

InChI=1S/C23H36N6O4/c1-15(2)22(32)28-10-6-23(7-11-28)12-18(21-25-16(3)26-33-21)29(14-23)13-19(30)27-8-4-17(5-9-27)20(24)31/h15,17-18H,4-14H2,1-3H3,(H2,24,31)/t18-/m0/s1

InChI Key

SZCPZNGWPYRVCU-SFHVURJKSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.58

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.227

Distribution Coefficient, logD

-0.247

Water Solubility, LogSw

-0.20

Polar Surface Area

102.520

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

6.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

78.26

SD03-0954 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SD03-0954 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD03-0954?
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What is the minimum amount of SD03-0954 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD03-0954
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD03-0954
  • 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 SD03-0954 available by request