E796-0150 Screening compound: 8-(azepane-1-carbonyl)-2-[(2-ethylphenyl)amino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one

E796-0150 Screening compound: 8-(azepane-1-carbonyl)-2-[(2-ethylphenyl)amino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
E796-0150 Screening compound: 8-(azepane-1-carbonyl)-2-[(2-ethylphenyl)amino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E796-0150
8-(azepane-1-carbonyl)-2-[(2-ethylphenyl)amino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one

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

E796-0150

Molecular Formula

C24H25N5O2S (C24 H25 N5 O2 S)

Compound Name

8-(azepane-1-carbonyl)-2-[(2-ethylphenyl)amino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one

IUPAC name

8-(azepane-1-carbonyl)-2-[(2-ethylphenyl)amino]-5H-[134]thiadiazolo[23-b]quinazolin-5-one

SMILES

CCc(cccc1)c1NC(SC1=Nc2c3ccc(C(N4CCCCCC4)=O)c2)=NN1C3=O

InChI

InChI=1S/C24H25N5O2S/c1-2-16-9-5-6-10-19(16)25-23-27-29-22(31)18-12-11-17(15-20(18)26-24(29)32-23)21(30)28-13-7-3-4-8-14-28/h5-6,9-12,15H,2-4,7-8,13-14H2,1H3,(H,25,27)

InChI Key

MJEWGTHZZBEXGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14919958

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.307

Distribution Coefficient, logD

4.303

Water Solubility, LogSw

-4.11

Polar Surface Area

63.148

Acid Dissociation Constant (pKa)

9.68

Base Dissociation Constant (pKb)

5.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with E796-0150 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E796-0150?
Check Price and Availability of E796-0150, 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 E796-0150 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E796-0150
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E796-0150
  • 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 E796-0150 available by request