SD63-0004 Screening compound: 3-[1-(benzylsulfonyl)tetrahydro-1H-pyrrol-3-yl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole

SD63-0004 Screening compound: 3-[1-(benzylsulfonyl)tetrahydro-1H-pyrrol-3-yl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole
SD63-0004 Screening compound: 3-[1-(benzylsulfonyl)tetrahydro-1H-pyrrol-3-yl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound SD63-0004
3-[1-(benzylsulfonyl)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

SD63-0004

Molecular Formula

C17H21N3O3S (C17 H21 N3 O3 S)

Compound Name

3-[1-(benzylsulfonyl)tetrahydro-1H-pyrrol-3-yl]-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole

IUPAC name

n/a

SMILES

O=S(Cc1ccccc1)(N(CC1)CC1c1n[nH]c2c1COCC2)=O

InChI

InChI=1S/C17H21N3O3S/c21-24(22,12-13-4-2-1-3-5-13)20-8-6-14(10-20)17-15-11-23-9-7-16(15)18-19-17/h1-5,14H,6-12H2,(H,18,19)/t14-/m1/s1

InChI Key

ZBKUFYPGYVNBDN-CQSZACIVSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.675

Distribution Coefficient, logD

1.675

Water Solubility, LogSw

-2.20

Polar Surface Area

65.231

Acid Dissociation Constant (pKa)

14.76

Base Dissociation Constant (pKb)

1.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.10

References: we are preparing a list of scientific research reports with SD63-0004 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD63-0004?
Check Price and Availability of SD63-0004, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of SD63-0004 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD63-0004
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD63-0004
  • 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 SD63-0004 available by request