5777-0210 Screening compound: (5Z)-5-{[3-chloro-5-ethoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene}-3-ethyl-2-sulfanylideneimidazolidin-4-one

5777-0210 Screening compound: (5Z)-5-{[3-chloro-5-ethoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene}-3-ethyl-2-sulfanylideneimidazolidin-4-one
5777-0210 Screening compound: (5Z)-5-{[3-chloro-5-ethoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene}-3-ethyl-2-sulfanylideneimidazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5777-0210
(5Z)-5-{[3-chloro-5-ethoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene}-3-ethyl-2-sulfanylideneimidazolidin-4-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

5777-0210

Molecular Formula

C17H19ClN2O3S (C17 H19 ClN2 O3 S)

Compound Name

(5Z)-5-{[3-chloro-5-ethoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene}-3-ethyl-2-sulfanylideneimidazolidin-4-one

IUPAC name

(5Z)-5-{[3-chloro-5-ethoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene}-3-ethyl-2-sulfanylideneimidazolidin-4-one

SMILES

CCN(C(/C(/N1)=C/c(cc2OCC)cc(Cl)c2OCC=C)=O)C1=S

InChI

InChI=1S/C17H19ClN2O3S/c1-4-7-23-15-12(18)8-11(10-14(15)22-6-3)9-13-16(21)20(5-2)17(24)19-13/h4,8-10H,1,5-7H2,2-3H3,(H,19,24)

InChI Key

DGXKVSXATCUSBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03710841

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.87

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.973

Distribution Coefficient, logD

3.961

Water Solubility, LogSw

-4.34

Polar Surface Area

42.306

Acid Dissociation Constant (pKa)

8.93

Base Dissociation Constant (pKb)

0.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

References: we are preparing a list of scientific research reports with 5777-0210 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5777-0210?
Check Price and Availability of 5777-0210, 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 5777-0210 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5777-0210
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5777-0210
  • 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 5777-0210 available by request