E580-0202 Screening compound: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[4-oxo-3-(2-phenylethyl)-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

E580-0202 Screening compound: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[4-oxo-3-(2-phenylethyl)-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
E580-0202 Screening compound: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[4-oxo-3-(2-phenylethyl)-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E580-0202
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[4-oxo-3-(2-phenylethyl)-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

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

E580-0202

Molecular Formula

C20H21N5O2S3 (C20 H21 N5 O2 S3)

Compound Name

N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[4-oxo-3-(2-phenylethyl)-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

IUPAC name

N-(5-ethyl-134-thiadiazol-2-yl)-2-{[4-oxo-3-(2-phenylethyl)-3H4H6H7H-thieno[32-d]pyrimidin-2-yl]sulfanyl}acetamide

SMILES

CCc1nnc(NC(CSC(N(CCc2ccccc2)C2=O)=NC3=C2SCC3)=O)s1

InChI

InChI=1S/C20H21N5O2S3/c1-2-16-23-24-19(30-16)22-15(26)12-29-20-21-14-9-11-28-17(14)18(27)25(20)10-8-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H,22,24,26)

InChI Key

BSYNXGAERWVLAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05963711

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.62

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.205

Distribution Coefficient, logD

3.176

Water Solubility, LogSw

-3.32

Polar Surface Area

73.276

Acid Dissociation Constant (pKa)

8.56

Base Dissociation Constant (pKb)

-0.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with E580-0202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E580-0202?
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What is the minimum amount of E580-0202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E580-0202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E580-0202
  • 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 E580-0202 available by request