SD01-1128 Screening compound: 1-(4-{[1-(cyclopropylmethyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]carbonyl}piperidino)-1-ethanone

SD01-1128 Screening compound: 1-(4-{[1-(cyclopropylmethyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]carbonyl}piperidino)-1-ethanone
SD01-1128 Screening compound: 1-(4-{[1-(cyclopropylmethyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]carbonyl}piperidino)-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SD01-1128
1-(4-{[1-(cyclopropylmethyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]carbonyl}piperidino)-1-ethanone

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

SD01-1128

Molecular Formula

C21H27N5O3 (C21 H27 N5 O3)

Compound Name

1-(4-{[1-(cyclopropylmethyl)-3-(1,3-oxazol-4-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]carbonyl}piperidino)-1-ethanone

IUPAC name

1-{4-[1-(cyclopropylmethyl)-3-(13-oxazol-4-yl)-1H4H5H6H7H-pyrazolo[43-c]pyridine-5-carbonyl]piperidin-1-yl}ethan-1-one

SMILES

CC(N(CC1)CCC1C(N(CC1)Cc2c1n(CC1CC1)nc2-c1cocn1)=O)=O

InChI

InChI=1S/C21H27N5O3/c1-14(27)24-7-4-16(5-8-24)21(28)25-9-6-19-17(11-25)20(18-12-29-13-22-18)23-26(19)10-15-2-3-15/h12-13,15-16H,2-11H2,1H3

InChI Key

QEDGJJUICFVLNZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32259602

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.48

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

0.838

Distribution Coefficient, logD

0.838

Water Solubility, LogSw

-0.95

Polar Surface Area

65.977

Acid Dissociation Constant (pKa)

22.78

Base Dissociation Constant (pKb)

8.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.90

SD01-1128 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 SD01-1128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD01-1128?
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What is the minimum amount of SD01-1128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD01-1128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD01-1128
  • 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 SD01-1128 available by request