SD01-1393 Screening compound: 1-(2-ethoxyethyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl (3-fluorobenzyl) sulfone

SD01-1393 Screening compound: 1-(2-ethoxyethyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl (3-fluorobenzyl) sulfone
SD01-1393 Screening compound: 1-(2-ethoxyethyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl (3-fluorobenzyl) sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound SD01-1393
1-(2-ethoxyethyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl (3-fluorobenzyl) 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

SD01-1393

Molecular Formula

C20H23FN4O4S (C20 H23 FN4 O4 S)

Compound Name

1-(2-ethoxyethyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl (3-fluorobenzyl) sulfone

IUPAC name

4-[1-(2-ethoxyethyl)-5-[(3-fluorophenyl)methanesulfonyl]-1H4H5H6H7H-pyrazolo[43-c]pyridin-3-yl]-13-oxazole

SMILES

CCOCCn(c(CC1)c2CN1S(Cc1cc(F)ccc1)(=O)=O)nc2-c1cocn1

InChI

InChI=1S/C20H23FN4O4S/c1-2-28-9-8-25-19-6-7-24(11-17(19)20(23-25)18-12-29-14-22-18)30(26,27)13-15-4-3-5-16(21)10-15/h3-5,10,12,14H,2,6-9,11,13H2,1H3

InChI Key

UGCNHLPEYQZZPD-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.910

Distribution Coefficient, logD

1.910

Water Solubility, LogSw

-2.43

Polar Surface Area

71.251

Acid Dissociation Constant (pKa)

19.91

Base Dissociation Constant (pKb)

-0.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

SD01-1393 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 SD01-1393 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of SD01-1393 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD01-1393
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD01-1393
  • 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 SD01-1393 available by request