E757-0242 Screening compound: 7-{[4-(azepane-1-carbonyl)phenyl]methyl}-hexahydro-1H-[1,3]thiazolo[3,4-a]pyrazine-5,8-dione

E757-0242 Screening compound: 7-{[4-(azepane-1-carbonyl)phenyl]methyl}-hexahydro-1H-[1,3]thiazolo[3,4-a]pyrazine-5,8-dione
E757-0242 Screening compound: 7-{[4-(azepane-1-carbonyl)phenyl]methyl}-hexahydro-1H-[1,3]thiazolo[3,4-a]pyrazine-5,8-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound E757-0242
7-{[4-(azepane-1-carbonyl)phenyl]methyl}-hexahydro-1H-[1,3]thiazolo[3,4-a]pyrazine-5,8-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

E757-0242

Molecular Formula

C20H25N3O3S (C20 H25 N3 O3 S)

Compound Name

7-{[4-(azepane-1-carbonyl)phenyl]methyl}-hexahydro-1H-[1,3]thiazolo[3,4-a]pyrazine-5,8-dione

IUPAC name

7-{[4-(azepane-1-carbonyl)phenyl]methyl}-hexahydro-1H-[13]thiazolo[34-a]pyrazine-58-dione

SMILES

O=C(c1ccc(CN(CC(N2C3CSC2)=O)C3=O)cc1)N1CCCCCC1

InChI

InChI=1S/C20H25N3O3S/c24-18-12-22(20(26)17-13-27-14-23(17)18)11-15-5-7-16(8-6-15)19(25)21-9-3-1-2-4-10-21/h5-8,17H,1-4,9-14H2/t17-/m1/s1

InChI Key

OQFWRHBHPAAQCZ-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD14916444

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.333

Distribution Coefficient, logD

1.333

Water Solubility, LogSw

-2.19

Polar Surface Area

50.636

Acid Dissociation Constant (pKa)

19.79

Base Dissociation Constant (pKb)

-1.38

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.00

References: we are preparing a list of scientific research reports with E757-0242 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E757-0242?
Check Price and Availability of E757-0242, 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 E757-0242 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E757-0242
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E757-0242
  • 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 E757-0242 available by request