SD69-0646 Screening compound: (6S)-6-isopropyl-N-[4-(4-morpholinyl)benzyl]-4-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxamide

SD69-0646 Screening compound: (6S)-6-isopropyl-N-[4-(4-morpholinyl)benzyl]-4-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxamide
SD69-0646 Screening compound: (6S)-6-isopropyl-N-[4-(4-morpholinyl)benzyl]-4-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SD69-0646
(6S)-6-isopropyl-N-[4-(4-morpholinyl)benzyl]-4-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxamide

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

SD69-0646

Molecular Formula

C20H26N6O3 (C20 H26 N6 O3)

Compound Name

(6S)-6-isopropyl-N-[4-(4-morpholinyl)benzyl]-4-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazine-3-carboxamide

IUPAC name

n/a

SMILES

CC(C)[C@@H](Cn1nnc(C(NCc(cc2)ccc2N2CCOCC2)=O)c11)NC1=O

InChI

InChI=1S/C20H26N6O3/c1-13(2)16-12-26-18(20(28)22-16)17(23-24-26)19(27)21-11-14-3-5-15(6-4-14)25-7-9-29-10-8-25/h3-6,13,16H,7-12H2,1-2H3,(H,21,27)(H,22,28)/t16-/m1/s1

InChI Key

KNYDWYBHAWQDMK-MRXNPFEDSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.690

Distribution Coefficient, logD

0.689

Water Solubility, LogSw

-1.87

Polar Surface Area

87.621

Acid Dissociation Constant (pKa)

12.47

Base Dissociation Constant (pKb)

4.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with SD69-0646 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD69-0646?
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What is the minimum amount of SD69-0646 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD69-0646
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD69-0646
  • 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 SD69-0646 available by request