E757-0149 Screening compound: N-cyclohexyl-4-({5,8-dioxo-hexahydro-1H-[1,3]thiazolo[3,4-a]pyrazin-7-yl}methyl)benzamide

E757-0149 Screening compound: N-cyclohexyl-4-({5,8-dioxo-hexahydro-1H-[1,3]thiazolo[3,4-a]pyrazin-7-yl}methyl)benzamide
E757-0149 Screening compound: N-cyclohexyl-4-({5,8-dioxo-hexahydro-1H-[1,3]thiazolo[3,4-a]pyrazin-7-yl}methyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E757-0149
N-cyclohexyl-4-({5,8-dioxo-hexahydro-1H-[1,3]thiazolo[3,4-a]pyrazin-7-yl}methyl)benzamide

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

E757-0149

Molecular Formula

C20H25N3O3S (C20 H25 N3 O3 S)

Compound Name

N-cyclohexyl-4-({5,8-dioxo-hexahydro-1H-[1,3]thiazolo[3,4-a]pyrazin-7-yl}methyl)benzamide

IUPAC name

N-cyclohexyl-4-({58-dioxo-hexahydro-1H-[13]thiazolo[34-a]pyrazin-7-yl}methyl)benzamide

SMILES

O=C(c1ccc(CN(CC(N2C3CSC2)=O)C3=O)cc1)NC1CCCCC1

InChI

InChI=1S/C20H25N3O3S/c24-18-11-22(20(26)17-12-27-13-23(17)18)10-14-6-8-15(9-7-14)19(25)21-16-4-2-1-3-5-16/h6-9,16-17H,1-5,10-13H2,(H,21,25)/t17-/m1/s1

InChI Key

GOONOZDHXGECPN-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD14916435

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.755

Distribution Coefficient, logD

1.755

Water Solubility, LogSw

-2.55

Polar Surface Area

57.796

Acid Dissociation Constant (pKa)

14.07

Base Dissociation Constant (pKb)

-1.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.00

E757-0149 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Soluble Diversity Library (15920 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with E757-0149 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E757-0149?
Check Price and Availability of E757-0149, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E757-0149 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E757-0149
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E757-0149
  • 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 E757-0149 available by request