C660-0371 Screening compound: 1-{6H,7H,8H,9H,10H-azepino[2,1-h]purin-4-yl}azepane

C660-0371 Screening compound: 1-{6H,7H,8H,9H,10H-azepino[2,1-h]purin-4-yl}azepane
C660-0371 Screening compound: 1-{6H,7H,8H,9H,10H-azepino[2,1-h]purin-4-yl}azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound C660-0371
1-{6H,7H,8H,9H,10H-azepino[2,1-h]purin-4-yl}azepane

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

C660-0371

Molecular Formula

C16H23N5 (C16 H23 N5)

Compound Name

1-{6H,7H,8H,9H,10H-azepino[2,1-h]purin-4-yl}azepane

IUPAC name

1-{6H7H8H9H10H-azepino[21-h]purin-4-yl}azepane

SMILES

C(CCC1)CCN1c1ncnc2c1nc1n2CCCCC1

InChI

InChI=1S/C16H23N5/c1-2-6-10-20(9-5-1)15-14-16(18-12-17-15)21-11-7-3-4-8-13(21)19-14/h12H,1-11H2

InChI Key

JFJHVUKDEAJADK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14780075

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

285.39

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.430

Distribution Coefficient, logD

3.425

Water Solubility, LogSw

-3.35

Polar Surface Area

36.926

Acid Dissociation Constant (pKa)

18.78

Base Dissociation Constant (pKb)

5.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

68.80

C660-0371 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 compounds)

Akt-Targeted Library (14764 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with C660-0371 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C660-0371?
Check Price and Availability of C660-0371, 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 C660-0371 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C660-0371
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C660-0371
  • 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 C660-0371 available by request