SD70-0173 Screening compound: 2-[(7S)-7-isobutyl-6-oxo-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-5(4H)-yl]-N~1~-methyl-N~1~-phenethylacetamide

SD70-0173 Screening compound: 2-[(7S)-7-isobutyl-6-oxo-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-5(4H)-yl]-N~1~-methyl-N~1~-phenethylacetamide
SD70-0173 Screening compound: 2-[(7S)-7-isobutyl-6-oxo-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-5(4H)-yl]-N~1~-methyl-N~1~-phenethylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SD70-0173
2-[(7S)-7-isobutyl-6-oxo-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-5(4H)-yl]-N~1~-methyl-N~1~-phenethylacetamide

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

SD70-0173

Molecular Formula

C20H27N5O2 (C20 H27 N5 O2)

Compound Name

2-[(7S)-7-isobutyl-6-oxo-6,7-dihydro[1,2,3]triazolo[1,5-a]pyrazin-5(4H)-yl]-N~1~-methyl-N~1~-phenethylacetamide

IUPAC name

n/a

SMILES

CC(C)C[C@@H]1n2nncc2CN(CC(N(C)CCc2ccccc2)=O)C1=O

InChI

InChI=1S/C20H27N5O2/c1-15(2)11-18-20(27)24(13-17-12-21-22-25(17)18)14-19(26)23(3)10-9-16-7-5-4-6-8-16/h4-8,12,15,18H,9-11,13-14H2,1-3H3/t18-/m0/s1

InChI Key

TXDUCGRVILQHTB-SFHVURJKSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.682

Distribution Coefficient, logD

1.682

Water Solubility, LogSw

-1.74

Polar Surface Area

59.066

Acid Dissociation Constant (pKa)

16.87

Base Dissociation Constant (pKb)

4.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

SD70-0173 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 SD70-0173 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD70-0173?
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What is the minimum amount of SD70-0173 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD70-0173
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD70-0173
  • 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 SD70-0173 available by request