S022-1927 Screening compound: 7-{[1-(morpholinosulfonyl)-4-piperidyl]carbonyl}-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one

S022-1927 Screening compound: 7-{[1-(morpholinosulfonyl)-4-piperidyl]carbonyl}-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one
S022-1927 Screening compound: 7-{[1-(morpholinosulfonyl)-4-piperidyl]carbonyl}-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S022-1927
7-{[1-(morpholinosulfonyl)-4-piperidyl]carbonyl}-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-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

S022-1927

Molecular Formula

C19H26N6O5S (C19 H26 N6 O5 S)

Compound Name

7-{[1-(morpholinosulfonyl)-4-piperidyl]carbonyl}-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one

IUPAC name

11-[1-(morpholine-4-sulfonyl)piperidine-4-carbonyl]-26711-tetraazatricyclo[7.4.0.0^{37}]trideca-1(9)24-trien-8-one

SMILES

O=C(C(CC1)CCN1S(N1CCOCC1)(=O)=O)N(CC1)CC(C2=O)=C1N=C1N2NC=C1

InChI

InChI=1S/C19H26N6O5S/c26-18(14-2-7-23(8-3-14)31(28,29)24-9-11-30-12-10-24)22-6-4-16-15(13-22)19(27)25-17(21-16)1-5-20-25/h1,5,14,20H,2-4,6-13H2

InChI Key

CQSGHWZUDFYCII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29033145

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.52

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

-1.845

Distribution Coefficient, logD

-1.845

Water Solubility, LogSw

-1.60

Polar Surface Area

97.041

Acid Dissociation Constant (pKa)

14.74

Base Dissociation Constant (pKb)

-2.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.16

S022-1927 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 S022-1927 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S022-1927?
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What is the minimum amount of S022-1927 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S022-1927
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S022-1927
  • 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 S022-1927 available by request