V014-7685 Screening compound: 4-[(6-acetyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)methyl]-N-butylbenzamide

V014-7685 Screening compound: 4-[(6-acetyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)methyl]-N-butylbenzamide
V014-7685 Screening compound: 4-[(6-acetyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)methyl]-N-butylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-7685
4-[(6-acetyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)methyl]-N-butylbenzamide

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

V014-7685

Molecular Formula

C22H24N2O4 (C22 H24 N2 O4)

Compound Name

4-[(6-acetyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)methyl]-N-butylbenzamide

IUPAC name

4-[(6-acetyl-3-oxo-34-dihydro-2H-14-benzoxazin-4-yl)methyl]-N-butylbenzamide

SMILES

CCCCNC(c1ccc(CN2c(cc(cc3)C(C)=O)c3OCC2=O)cc1)=O

InChI

InChI=1S/C22H24N2O4/c1-3-4-11-23-22(27)17-7-5-16(6-8-17)13-24-19-12-18(15(2)25)9-10-20(19)28-14-21(24)26/h5-10,12H,3-4,11,13-14H2,1-2H3,(H,23,27)

InChI Key

ZWMDDPPDCCRCBD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19773232

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.599

Distribution Coefficient, logD

2.599

Water Solubility, LogSw

-3.02

Polar Surface Area

62.421

Acid Dissociation Constant (pKa)

13.45

Base Dissociation Constant (pKb)

-1.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

References: we are preparing a list of scientific research reports with V014-7685 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-7685?
Check Price and Availability of V014-7685, 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 V014-7685 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-7685
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-7685
  • 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 V014-7685 available by request