4311-2584 Screening compound: (5E)-5-{2-[(2E)-1,3-diethyl-5-trifluoromethanesulfonyl-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]ethylidene}-3-ethyl-2-sulfanylidene-1,3-oxazolidin-4-one

4311-2584 Screening compound: (5E)-5-{2-[(2E)-1,3-diethyl-5-trifluoromethanesulfonyl-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]ethylidene}-3-ethyl-2-sulfanylidene-1,3-oxazolidin-4-one
4311-2584 Screening compound: (5E)-5-{2-[(2E)-1,3-diethyl-5-trifluoromethanesulfonyl-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]ethylidene}-3-ethyl-2-sulfanylidene-1,3-oxazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4311-2584
(5E)-5-{2-[(2E)-1,3-diethyl-5-trifluoromethanesulfonyl-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]ethylidene}-3-ethyl-2-sulfanylidene-1,3-oxazolidin-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

4311-2584

Molecular Formula

C19H20F3N3O4S2 (C19 H20 F3 N3 O4 S2)

Compound Name

(5E)-5-{2-[(2E)-1,3-diethyl-5-trifluoromethanesulfonyl-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]ethylidene}-3-ethyl-2-sulfanylidene-1,3-oxazolidin-4-one

IUPAC name

(5E)-5-{2-[(2E)-13-diethyl-5-trifluoromethanesulfonyl-23-dihydro-1H-13-benzodiazol-2-ylidene]ethylidene}-3-ethyl-2-sulfanylidene-13-oxazolidin-4-one

SMILES

CCN1c(ccc(S(C(F)(F)F)(=O)=O)c2)c2N(CC)/C1=C/C=C(\C(N1CC)=O)/OC1=S

InChI

InChI=1S/C19H20F3N3O4S2/c1-4-23-13-8-7-12(31(27,28)19(20,21)22)11-14(13)24(5-2)16(23)10-9-15-17(26)25(6-3)18(30)29-15/h7-11H,4-6H2,1-3H3

InChI Key

RJASAEFNWLFOBS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00570816

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.551

Distribution Coefficient, logD

4.551

Water Solubility, LogSw

-4.43

Polar Surface Area

56.508

Acid Dissociation Constant (pKa)

29.67

Base Dissociation Constant (pKb)

-0.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

4311-2584 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4311-2584 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4311-2584?
Check Price and Availability of 4311-2584, 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 4311-2584 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4311-2584
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4311-2584
  • 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 4311-2584 available by request