V022-4509 Screening compound: N-[2-(dimethylamino)ethyl]-4-{6-[2-(2-methoxyphenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}butanamide

V022-4509 Screening compound: N-[2-(dimethylamino)ethyl]-4-{6-[2-(2-methoxyphenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}butanamide
V022-4509 Screening compound: N-[2-(dimethylamino)ethyl]-4-{6-[2-(2-methoxyphenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-4509
N-[2-(dimethylamino)ethyl]-4-{6-[2-(2-methoxyphenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}butanamide

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

V022-4509

Molecular Formula

C25H31N3O6 (C25 H31 N3 O6)

Compound Name

N-[2-(dimethylamino)ethyl]-4-{6-[2-(2-methoxyphenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}butanamide

IUPAC name

N-[2-(dimethylamino)ethyl]-4-{6-[2-(2-methoxyphenoxy)acetyl]-3-oxo-34-dihydro-2H-14-benzoxazin-4-yl}butanamide

SMILES

CN(C)CCNC(CCCN1c(cc(cc2)C(COc(cccc3)c3OC)=O)c2OCC1=O)=O

InChI

InChI=1S/C25H31N3O6/c1-27(2)14-12-26-24(30)9-6-13-28-19-15-18(10-11-21(19)34-17-25(28)31)20(29)16-33-23-8-5-4-7-22(23)32-3/h4-5,7-8,10-11,15H,6,9,12-14,16-17H2,1-3H3,(H,26,30)

InChI Key

LXSBTDITCYKMIS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19979357

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

469.54

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.599

Distribution Coefficient, logD

-0.946

Water Solubility, LogSw

-2.09

Polar Surface Area

80.688

Acid Dissociation Constant (pKa)

13.80

Base Dissociation Constant (pKb)

8.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with V022-4509 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-4509?
Check Price and Availability of V022-4509, 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 V022-4509 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-4509
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-4509
  • 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 V022-4509 available by request