V018-9602 Screening compound: 2-{6-[2-(2-chlorophenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}-N-cyclohexylacetamide

V018-9602 Screening compound: 2-{6-[2-(2-chlorophenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}-N-cyclohexylacetamide
V018-9602 Screening compound: 2-{6-[2-(2-chlorophenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}-N-cyclohexylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-9602
2-{6-[2-(2-chlorophenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}-N-cyclohexylacetamide

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

V018-9602

Molecular Formula

C24H25ClN2O5 (C24 H25 ClN2 O5)

Compound Name

2-{6-[2-(2-chlorophenoxy)acetyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl}-N-cyclohexylacetamide

IUPAC name

2-{6-[2-(2-chlorophenoxy)acetyl]-3-oxo-34-dihydro-2H-14-benzoxazin-4-yl}-N-cyclohexylacetamide

SMILES

O=C(COc(cccc1)c1Cl)c(cc1)cc(N2CC(NC3CCCCC3)=O)c1OCC2=O

InChI

InChI=1S/C24H25ClN2O5/c25-18-8-4-5-9-21(18)31-14-20(28)16-10-11-22-19(12-16)27(24(30)15-32-22)13-23(29)26-17-6-2-1-3-7-17/h4-5,8-12,17H,1-3,6-7,13-15H2,(H,26,29)

InChI Key

PHIJVQRCKHATFC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19891602

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.93

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.512

Distribution Coefficient, logD

3.512

Water Solubility, LogSw

-4.01

Polar Surface Area

68.826

Acid Dissociation Constant (pKa)

15.47

Base Dissociation Constant (pKb)

1.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with V018-9602 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-9602?
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What is the minimum amount of V018-9602 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-9602
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-9602
  • 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 V018-9602 available by request