SB41-1007 Screening compound: 2-[(5S,8aS)-5-isobutyl-7-(2-methoxyethyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N~1~-[2-(isopropylamino)-2-oxoethyl]-N~1~-methylacetamide

SB41-1007 Screening compound: 2-[(5S,8aS)-5-isobutyl-7-(2-methoxyethyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N~1~-[2-(isopropylamino)-2-oxoethyl]-N~1~-methylacetamide
SB41-1007 Screening compound: 2-[(5S,8aS)-5-isobutyl-7-(2-methoxyethyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N~1~-[2-(isopropylamino)-2-oxoethyl]-N~1~-methylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB41-1007
2-[(5S,8aS)-5-isobutyl-7-(2-methoxyethyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N~1~-[2-(isopropylamino)-2-oxoethyl]-N~1~-methylacetamide

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

SB41-1007

Molecular Formula

C21H37N5O5 (C21 H37 N5 O5)

Compound Name

2-[(5S,8aS)-5-isobutyl-7-(2-methoxyethyl)-3,6-dioxohexahydroimidazo[1,5-a]pyrazin-2(3H)-yl]-N~1~-[2-(isopropylamino)-2-oxoethyl]-N~1~-methylacetamide

IUPAC name

2-{2-[(5S8aS)-7-(2-methoxyethyl)-5-(2-methylpropyl)-36-dioxo-octahydroimidazo[15-a]pyrazin-2-yl]-N-methylacetamido}-N-(propan-2-yl)acetamide

SMILES

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

InChI

InChI=1S/C21H37N5O5/c1-14(2)9-17-20(29)24(7-8-31-6)10-16-11-25(21(30)26(16)17)13-19(28)23(5)12-18(27)22-15(3)4/h14-17H,7-13H2,1-6H3,(H,22,27)/t16-,17+/m1/s1

InChI Key

UNGLUQMRQRIPCN-SJORKVTESA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.010

Distribution Coefficient, logD

0.010

Water Solubility, LogSw

-0.91

Polar Surface Area

84.571

Acid Dissociation Constant (pKa)

15.37

Base Dissociation Constant (pKb)

4.71

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

80.95

References: we are preparing a list of scientific research reports with SB41-1007 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB41-1007?
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What is the minimum amount of SB41-1007 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB41-1007
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB41-1007
  • 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 SB41-1007 available by request