SB42-0407 Screening compound: (5S,8aR)-5-isobutyl-7-(2-methoxyethyl)-2-(2-morpholino-2-oxoethyl)tetrahydroimidazo[1,5-a]pyrazine-3,6(2H,5H)-dione

SB42-0407 Screening compound: (5S,8aR)-5-isobutyl-7-(2-methoxyethyl)-2-(2-morpholino-2-oxoethyl)tetrahydroimidazo[1,5-a]pyrazine-3,6(2H,5H)-dione
SB42-0407 Screening compound: (5S,8aR)-5-isobutyl-7-(2-methoxyethyl)-2-(2-morpholino-2-oxoethyl)tetrahydroimidazo[1,5-a]pyrazine-3,6(2H,5H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound SB42-0407
(5S,8aR)-5-isobutyl-7-(2-methoxyethyl)-2-(2-morpholino-2-oxoethyl)tetrahydroimidazo[1,5-a]pyrazine-3,6(2H,5H)-dione

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

SB42-0407

Molecular Formula

C19H32N4O5 (C19 H32 N4 O5)

Compound Name

(5S,8aR)-5-isobutyl-7-(2-methoxyethyl)-2-(2-morpholino-2-oxoethyl)tetrahydroimidazo[1,5-a]pyrazine-3,6(2H,5H)-dione

IUPAC name

(5S8aR)-7-(2-methoxyethyl)-5-(2-methylpropyl)-2-[2-(morpholin-4-yl)-2-oxoethyl]-octahydroimidazo[15-a]pyrazine-36-dione

SMILES

CC(C)C[C@@H](C(N(CCOC)C[C@@H]1CN2CC(N3CCOCC3)=O)=O)N1C2=O

InChI

InChI=1S/C19H32N4O5/c1-14(2)10-16-18(25)21(4-7-27-3)11-15-12-22(19(26)23(15)16)13-17(24)20-5-8-28-9-6-20/h14-16H,4-13H2,1-3H3/t15-,16-/m0/s1

InChI Key

LRJAGSVYSAQSNZ-HOTGVXAUSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-0.206

Distribution Coefficient, logD

-0.206

Water Solubility, LogSw

-0.07

Polar Surface Area

69.260

Acid Dissociation Constant (pKa)

20.95

Base Dissociation Constant (pKb)

-0.40

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

84.21

References: we are preparing a list of scientific research reports with SB42-0407 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB42-0407?
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What is the minimum amount of SB42-0407 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB42-0407
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB42-0407
  • 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 SB42-0407 available by request