F848-0211 Screening compound: 1-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-[5-(piperidine-1-sulfonyl)-1H-1,2,3-benzotriazol-1-yl]butan-1-one

F848-0211 Screening compound: 1-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-[5-(piperidine-1-sulfonyl)-1H-1,2,3-benzotriazol-1-yl]butan-1-one
F848-0211 Screening compound: 1-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-[5-(piperidine-1-sulfonyl)-1H-1,2,3-benzotriazol-1-yl]butan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F848-0211
1-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-[5-(piperidine-1-sulfonyl)-1H-1,2,3-benzotriazol-1-yl]butan-1-one

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

F848-0211

Molecular Formula

C22H31N5O5S (C22 H31 N5 O5 S)

Compound Name

1-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-[5-(piperidine-1-sulfonyl)-1H-1,2,3-benzotriazol-1-yl]butan-1-one

IUPAC name

1-{14-dioxa-8-azaspiro[4.5]decan-8-yl}-4-[5-(piperidine-1-sulfonyl)-1H-123-benzotriazol-1-yl]butan-1-one

SMILES

O=C(CCCn1nnc2c1ccc(S(N1CCCCC1)(=O)=O)c2)N(CC1)CCC11OCCO1

InChI

InChI=1S/C22H31N5O5S/c28-21(25-13-8-22(9-14-25)31-15-16-32-22)5-4-12-27-20-7-6-18(17-19(20)23-24-27)33(29,30)26-10-2-1-3-11-26/h6-7,17H,1-5,8-16H2

InChI Key

WBRWOQYKBTUQJJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27199568

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.58

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.690

Distribution Coefficient, logD

0.690

Water Solubility, LogSw

-2.32

Polar Surface Area

88.183

Acid Dissociation Constant (pKa)

23.27

Base Dissociation Constant (pKb)

1.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

68.20

References: we are preparing a list of scientific research reports with F848-0211 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F848-0211?
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What is the minimum amount of F848-0211 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F848-0211
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F848-0211
  • 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 F848-0211 available by request