8008-7979 Screening compound: 1,3-dioxo-2-[(oxolan-2-yl)methyl]-N-(1,3-thiazol-2-yl)-2,3-dihydro-1H-isoindole-5-carboxamide

8008-7979 Screening compound: 1,3-dioxo-2-[(oxolan-2-yl)methyl]-N-(1,3-thiazol-2-yl)-2,3-dihydro-1H-isoindole-5-carboxamide
8008-7979 Screening compound: 1,3-dioxo-2-[(oxolan-2-yl)methyl]-N-(1,3-thiazol-2-yl)-2,3-dihydro-1H-isoindole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-7979
1,3-dioxo-2-[(oxolan-2-yl)methyl]-N-(1,3-thiazol-2-yl)-2,3-dihydro-1H-isoindole-5-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

8008-7979

Molecular Formula

C17H15N3O4S (C17 H15 N3 O4 S)

Compound Name

1,3-dioxo-2-[(oxolan-2-yl)methyl]-N-(1,3-thiazol-2-yl)-2,3-dihydro-1H-isoindole-5-carboxamide

IUPAC name

13-dioxo-2-[(oxolan-2-yl)methyl]-N-(13-thiazol-2-yl)-23-dihydro-1H-isoindole-5-carboxamide

SMILES

O=C(c(cc1)cc(C(N2CC3OCCC3)=O)c1C2=O)Nc1nccs1

InChI

InChI=1S/C17H15N3O4S/c21-14(19-17-18-5-7-25-17)10-3-4-12-13(8-10)16(23)20(15(12)22)9-11-2-1-6-24-11/h3-5,7-8,11H,1-2,6,9H2,(H,18,19,21)/t11-/m1/s1

InChI Key

JVLSEXAUIJOAGM-LLVKDONJSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.39

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.734

Distribution Coefficient, logD

1.552

Water Solubility, LogSw

-2.65

Polar Surface Area

71.715

Acid Dissociation Constant (pKa)

7.68

Base Dissociation Constant (pKb)

0.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.40

References: we are preparing a list of scientific research reports with 8008-7979 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-7979?
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What is the minimum amount of 8008-7979 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-7979
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-7979
  • 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 8008-7979 available by request