SD01-0425 Screening compound: 1-(3-methoxypropyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl (3-pyridyl) sulfone

SD01-0425 Screening compound: 1-(3-methoxypropyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl (3-pyridyl) sulfone
SD01-0425 Screening compound: 1-(3-methoxypropyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl (3-pyridyl) sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound SD01-0425
1-(3-methoxypropyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl (3-pyridyl) sulfone

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

SD01-0425

Molecular Formula

C18H21N5O4S (C18 H21 N5 O4 S)

Compound Name

1-(3-methoxypropyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl (3-pyridyl) sulfone

IUPAC name

3-{[1-(3-methoxypropyl)-3-(13-oxazol-4-yl)-1H4H5H6H7H-pyrazolo[43-c]pyridin-5-yl]sulfonyl}pyridine

SMILES

COCCCn(c(CC1)c2CN1S(c1cnccc1)(=O)=O)nc2-c1cocn1

InChI

InChI=1S/C18H21N5O4S/c1-26-9-3-7-23-17-5-8-22(28(24,25)14-4-2-6-19-10-14)11-15(17)18(21-23)16-12-27-13-20-16/h2,4,6,10,12-13H,3,5,7-9,11H2,1H3

InChI Key

WNCFXSAHWFDFIS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32260325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.46

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.679

Distribution Coefficient, logD

0.679

Water Solubility, LogSw

-1.64

Polar Surface Area

81.239

Acid Dissociation Constant (pKa)

21.97

Base Dissociation Constant (pKb)

-0.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.89

SD01-0425 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 SD01-0425 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of SD01-0425 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD01-0425
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD01-0425
  • 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 SD01-0425 available by request