SD08-0526 Screening compound: N'-{[1-(ethylsulfonyl)-4'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}-N,N-dimethylurea

SD08-0526 Screening compound: N'-{[1-(ethylsulfonyl)-4'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}-N,N-dimethylurea
SD08-0526 Screening compound: N'-{[1-(ethylsulfonyl)-4'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}-N,N-dimethylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound SD08-0526
N'-{[1-(ethylsulfonyl)-4'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}-N,N-dimethylurea

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

SD08-0526

Molecular Formula

C15H26N6O4S (C15 H26 N6 O4 S)

Compound Name

N'-{[1-(ethylsulfonyl)-4'H-spiro[piperidine-3,6'-[1,2,3]triazolo[5,1-c][1,4]oxazin]-3'-yl]methyl}-N,N-dimethylurea

IUPAC name

n/a

SMILES

CCS(N(CCC1)CC11OCc2c(CNC(N(C)C)=O)nnn2C1)(=O)=O

InChI

InChI=1S/C15H26N6O4S/c1-4-26(23,24)20-7-5-6-15(10-20)11-21-13(9-25-15)12(17-18-21)8-16-14(22)19(2)3/h4-11H2,1-3H3,(H,16,22)/t15-/m1/s1

InChI Key

SGLOEKUQTNAMTN-OAHLLOKOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-1.086

Distribution Coefficient, logD

-1.086

Water Solubility, LogSw

-1.22

Polar Surface Area

92.036

Acid Dissociation Constant (pKa)

14.95

Base Dissociation Constant (pKb)

4.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

80.00

SD08-0526 in Drug Discovery

Included in Screening Libraries

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 SD08-0526 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD08-0526?
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What is the minimum amount of SD08-0526 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD08-0526
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD08-0526
  • 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 SD08-0526 available by request