D635-0029 Screening compound: 3-hydroxy-4-[(piperidin-1-yl)methyl]-6H,7H,8H,9H,10H,11H-cyclohepta[c]chromen-6-one

D635-0029 Screening compound: 3-hydroxy-4-[(piperidin-1-yl)methyl]-6H,7H,8H,9H,10H,11H-cyclohepta[c]chromen-6-one
D635-0029 Screening compound: 3-hydroxy-4-[(piperidin-1-yl)methyl]-6H,7H,8H,9H,10H,11H-cyclohepta[c]chromen-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D635-0029
3-hydroxy-4-[(piperidin-1-yl)methyl]-6H,7H,8H,9H,10H,11H-cyclohepta[c]chromen-6-one

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

D635-0029

Molecular Formula

C20H25NO3 (C20 H25 NO3)

Compound Name

3-hydroxy-4-[(piperidin-1-yl)methyl]-6H,7H,8H,9H,10H,11H-cyclohepta[c]chromen-6-one

IUPAC name

3-hydroxy-4-[(piperidin-1-yl)methyl]-6H7H8H9H10H11H-cyclohepta[c]chromen-6-one

SMILES

Oc(cc1)c(CN2CCCCC2)c(O2)c1C(CCCCC1)=C1C2=O

InChI

InChI=1S/C20H25NO3/c22-18-10-9-15-14-7-3-1-4-8-16(14)20(23)24-19(15)17(18)13-21-11-5-2-6-12-21/h9-10,22H,1-8,11-13H2

InChI Key

GGUZEBCHMIFFJH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04013769

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.217

Distribution Coefficient, logD

3.283

Water Solubility, LogSw

-3.93

Polar Surface Area

41.377

Acid Dissociation Constant (pKa)

9.38

Base Dissociation Constant (pKb)

8.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.00

D635-0029 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Nervous system
Targets:
  • Kinases
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with D635-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D635-0029?
Check Price and Availability of D635-0029, 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 D635-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D635-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D635-0029
  • 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 D635-0029 available by request