V021-8069 Screening compound: N-(4-BENZYL-2-ETHYL-3-OXO-2,3,4,5-TETRAHYDRO-1,4-BENZOXAZEPIN-7-YL)-3,3-DIMETHYLBUTANAMIDE

V021-8069 Screening compound: N-(4-BENZYL-2-ETHYL-3-OXO-2,3,4,5-TETRAHYDRO-1,4-BENZOXAZEPIN-7-YL)-3,3-DIMETHYLBUTANAMIDE
V021-8069 Screening compound: N-(4-BENZYL-2-ETHYL-3-OXO-2,3,4,5-TETRAHYDRO-1,4-BENZOXAZEPIN-7-YL)-3,3-DIMETHYLBUTANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-8069
N-(4-BENZYL-2-ETHYL-3-OXO-2,3,4,5-TETRAHYDRO-1,4-BENZOXAZEPIN-7-YL)-3,3-DIMETHYLBUTANAMIDE

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

V021-8069

Molecular Formula

C24H30N2O3 (C24 H30 N2 O3)

Compound Name

N-(4-BENZYL-2-ETHYL-3-OXO-2,3,4,5-TETRAHYDRO-1,4-BENZOXAZEPIN-7-YL)-3,3-DIMETHYLBUTANAMIDE

IUPAC name

N-(4-benzyl-2-ethyl-3-oxo-2345-tetrahydro-14-benzoxazepin-7-yl)-33-dimethylbutanamide

SMILES

CCC(C(N(Cc1ccccc1)C1)=O)Oc(cc2)c1cc2NC(CC(C)(C)C)=O

InChI

InChI=1S/C24H30N2O3/c1-5-20-23(28)26(15-17-9-7-6-8-10-17)16-18-13-19(11-12-21(18)29-20)25-22(27)14-24(2,3)4/h6-13,20H,5,14-16H2,1-4H3,(H,25,27)/t20-/m0/s1

InChI Key

VYELIZKATXTWDD-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19848963

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.769

Distribution Coefficient, logD

4.769

Water Solubility, LogSw

-4.59

Polar Surface Area

47.925

Acid Dissociation Constant (pKa)

11.72

Base Dissociation Constant (pKb)

1.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

V021-8069 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V021-8069 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-8069?
Check Price and Availability of V021-8069, 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 V021-8069 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-8069
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-8069
  • 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 V021-8069 available by request