V004-0405 Screening compound: ethyl 6,7-dichloro-3-[4-(2-methoxy-2-oxoacetyl)piperazin-1-yl]quinoxaline-2-carboxylate

V004-0405 Screening compound: ethyl 6,7-dichloro-3-[4-(2-methoxy-2-oxoacetyl)piperazin-1-yl]quinoxaline-2-carboxylate
V004-0405 Screening compound: ethyl 6,7-dichloro-3-[4-(2-methoxy-2-oxoacetyl)piperazin-1-yl]quinoxaline-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-0405
ethyl 6,7-dichloro-3-[4-(2-methoxy-2-oxoacetyl)piperazin-1-yl]quinoxaline-2-carboxylate

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

V004-0405

Molecular Formula

C18H18Cl2N4O5 (C18 H18 Cl2 N4 O5)

Compound Name

ethyl 6,7-dichloro-3-[4-(2-methoxy-2-oxoacetyl)piperazin-1-yl]quinoxaline-2-carboxylate

IUPAC name

ethyl 67-dichloro-3-[4-(2-methoxy-2-oxoacetyl)piperazin-1-yl]quinoxaline-2-carboxylate

SMILES

CCOC(c1c(N(CC2)CCN2C(C(OC)=O)=O)nc(cc(c(Cl)c2)Cl)c2n1)=O

InChI

InChI=1S/C18H18Cl2N4O5/c1-3-29-17(26)14-15(22-13-9-11(20)10(19)8-12(13)21-14)23-4-6-24(7-5-23)16(25)18(27)28-2/h8-9H,3-7H2,1-2H3

InChI Key

DFSFQUWDKCDIIK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19955280

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

441.27

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.387

Distribution Coefficient, logD

3.387

Water Solubility, LogSw

-3.56

Polar Surface Area

79.983

Acid Dissociation Constant (pKa)

24.89

Base Dissociation Constant (pKb)

0.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

V004-0405 in Drug Discovery

Included in Screening Libraries

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V004-0405 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-0405?
Check Price and Availability of V004-0405, 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 V004-0405 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-0405
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-0405
  • 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 V004-0405 available by request