Y206-0653 Screening compound: (4-methyl-1,4-diazepan-1-yl)(5-methyl-2-furyl)methanone

Y206-0653 Screening compound: (4-methyl-1,4-diazepan-1-yl)(5-methyl-2-furyl)methanone
Y206-0653 Screening compound: (4-methyl-1,4-diazepan-1-yl)(5-methyl-2-furyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y206-0653
(4-methyl-1,4-diazepan-1-yl)(5-methyl-2-furyl)methanone

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

Y206-0653

Molecular Formula

C12H18N2O2 (C12 H18 N2 O2)

Compound Name

(4-methyl-1,4-diazepan-1-yl)(5-methyl-2-furyl)methanone

IUPAC name

1-methyl-4-(5-methylfuran-2-carbonyl)-14-diazepane

SMILES

Cc1ccc(C(N2CCN(C)CCC2)=O)o1

InChI

InChI=1S/C12H18N2O2/c1-10-4-5-11(16-10)12(15)14-7-3-6-13(2)8-9-14/h4-5H,3,6-9H2,1-2H3

InChI Key

VGEZXSQEYHDUCR-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

222.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.128

Distribution Coefficient, logD

0.217

Water Solubility, LogSw

-1.69

Polar Surface Area

28.787

Acid Dissociation Constant (pKa)

27.31

Base Dissociation Constant (pKb)

8.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.33

Y206-0653 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with Y206-0653 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y206-0653?
Check Price and Availability of Y206-0653, 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 Y206-0653 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y206-0653
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y206-0653
  • 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 Y206-0653 available by request