SD63-0047 Screening compound: 3-{1-[(3-fluorophenyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole

SD63-0047 Screening compound: 3-{1-[(3-fluorophenyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole
SD63-0047 Screening compound: 3-{1-[(3-fluorophenyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound SD63-0047
3-{1-[(3-fluorophenyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole

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

SD63-0047

Molecular Formula

C16H18FN3O3S (C16 H18 FN3 O3 S)

Compound Name

3-{1-[(3-fluorophenyl)sulfonyl]tetrahydro-1H-pyrrol-3-yl}-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole

IUPAC name

n/a

SMILES

O=S(c1cc(F)ccc1)(N(CC1)CC1c1n[nH]c2c1COCC2)=O

InChI

InChI=1S/C16H18FN3O3S/c17-12-2-1-3-13(8-12)24(21,22)20-6-4-11(9-20)16-14-10-23-7-5-15(14)18-19-16/h1-3,8,11H,4-7,9-10H2,(H,18,19)/t11-/m1/s1

InChI Key

SAPKXUIKHJXVTN-LLVKDONJSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.148

Distribution Coefficient, logD

2.148

Water Solubility, LogSw

-2.62

Polar Surface Area

65.337

Acid Dissociation Constant (pKa)

14.76

Base Dissociation Constant (pKb)

1.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.80

References: we are preparing a list of scientific research reports with SD63-0047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD63-0047?
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What is the minimum amount of SD63-0047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD63-0047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD63-0047
  • 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 SD63-0047 available by request