SB99-0132 Screening compound: 3-{5-[(3,5-dimethyl-4-isoxazolyl)carbonyl]-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}-1-piperidino-1-propanone

SB99-0132 Screening compound: 3-{5-[(3,5-dimethyl-4-isoxazolyl)carbonyl]-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}-1-piperidino-1-propanone
SB99-0132 Screening compound: 3-{5-[(3,5-dimethyl-4-isoxazolyl)carbonyl]-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}-1-piperidino-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SB99-0132
3-{5-[(3,5-dimethyl-4-isoxazolyl)carbonyl]-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}-1-piperidino-1-propanone

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

SB99-0132

Molecular Formula

C21H29N5O3 (C21 H29 N5 O3)

Compound Name

3-{5-[(3,5-dimethyl-4-isoxazolyl)carbonyl]-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl}-1-piperidino-1-propanone

IUPAC name

3-[5-(35-dimethyl-12-oxazole-4-carbonyl)-1-methyl-1H4H5H6H7H-pyrazolo[43-c]pyridin-3-yl]-1-(piperidin-1-yl)propan-1-one

SMILES

Cc1noc(C)c1C(N(CC1)Cc2c1n(C)nc2CCC(N1CCCCC1)=O)=O

InChI

InChI=1S/C21H29N5O3/c1-14-20(15(2)29-23-14)21(28)26-12-9-18-16(13-26)17(22-24(18)3)7-8-19(27)25-10-5-4-6-11-25/h4-13H2,1-3H3

InChI Key

UTQOMDFBAALKNE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32251419

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.586

Distribution Coefficient, logD

0.586

Water Solubility, LogSw

-0.26

Polar Surface Area

70.221

Acid Dissociation Constant (pKa)

21.26

Base Dissociation Constant (pKb)

1.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.90

SB99-0132 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SB99-0132 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB99-0132?
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What is the minimum amount of SB99-0132 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB99-0132
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB99-0132
  • 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 SB99-0132 available by request