SC99-0222 Screening compound: {4-[(dimethylamino)methyl]-5-methyl-3-isoxazolyl}[3-(1H-imidazol-2-yl)-1-isopropyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]methanone

SC99-0222 Screening compound: {4-[(dimethylamino)methyl]-5-methyl-3-isoxazolyl}[3-(1H-imidazol-2-yl)-1-isopropyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]methanone
SC99-0222 Screening compound: {4-[(dimethylamino)methyl]-5-methyl-3-isoxazolyl}[3-(1H-imidazol-2-yl)-1-isopropyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SC99-0222
{4-[(dimethylamino)methyl]-5-methyl-3-isoxazolyl}[3-(1H-imidazol-2-yl)-1-isopropyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]methanone

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

SC99-0222

Molecular Formula

C20H27N7O2 (C20 H27 N7 O2)

Compound Name

{4-[(dimethylamino)methyl]-5-methyl-3-isoxazolyl}[3-(1H-imidazol-2-yl)-1-isopropyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]methanone

IUPAC name

({3-[3-(1H-imidazol-2-yl)-1-(propan-2-yl)-1H4H5H6H7H-pyrazolo[43-c]pyridine-5-carbonyl]-5-methyl-12-oxazol-4-yl}methyl)dimethylamine

SMILES

CC(C)n(c(CC1)c2CN1C(c1noc(C)c1CN(C)C)=O)nc2-c1ncc[nH]1

InChI

InChI=1S/C20H27N7O2/c1-12(2)27-16-6-9-26(11-15(16)17(23-27)19-21-7-8-22-19)20(28)18-14(10-25(4)5)13(3)29-24-18/h7-8,12H,6,9-11H2,1-5H3,(H,21,22)

InChI Key

PLQBPOFRYFFQJW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32260548

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.586

Distribution Coefficient, logD

-4.699

Water Solubility, LogSw

-1.55

Polar Surface Area

78.050

Acid Dissociation Constant (pKa)

9.66

Base Dissociation Constant (pKb)

12.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

SC99-0222 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SC99-0222 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC99-0222?
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What is the minimum amount of SC99-0222 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC99-0222
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC99-0222
  • 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 SC99-0222 available by request