F850-1695 Screening compound: 2-(6-chloro-4-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-yl)-N-cycloheptylacetamide

F850-1695 Screening compound: 2-(6-chloro-4-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-yl)-N-cycloheptylacetamide
F850-1695 Screening compound: 2-(6-chloro-4-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-yl)-N-cycloheptylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F850-1695
2-(6-chloro-4-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-yl)-N-cycloheptylacetamide

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

F850-1695

Molecular Formula

C18H25ClN2O2 (C18 H25 ClN2 O2)

Compound Name

2-(6-chloro-4-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-yl)-N-cycloheptylacetamide

IUPAC name

n/a

SMILES

CN1c(cc(cc2)Cl)c2OCC1CC(NC1CCCCCC1)=O

InChI

InChI=1S/C18H25ClN2O2/c1-21-15(12-23-17-9-8-13(19)10-16(17)21)11-18(22)20-14-6-4-2-3-5-7-14/h8-10,14-15H,2-7,11-12H2,1H3,(H,20,22)/t15-/m0/s1

InChI Key

BFTNAYCHPNZXKZ-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD27199873

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.86

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.965

Distribution Coefficient, logD

3.965

Water Solubility, LogSw

-4.35

Polar Surface Area

35.010

Acid Dissociation Constant (pKa)

14.28

Base Dissociation Constant (pKb)

6.73

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.11

F850-1695 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with F850-1695 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F850-1695?
Check Price and Availability of F850-1695, 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 F850-1695 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F850-1695
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F850-1695
  • 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 F850-1695 available by request