E714-0267F Screening compound: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3H,4H,6H,7H,8H,9H,10H-azepino[2,1-h]purin-4-one

E714-0267F Screening compound: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3H,4H,6H,7H,8H,9H,10H-azepino[2,1-h]purin-4-one
E714-0267F Screening compound: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3H,4H,6H,7H,8H,9H,10H-azepino[2,1-h]purin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E714-0267F
3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3H,4H,6H,7H,8H,9H,10H-azepino[2,1-h]purin-4-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

E714-0267F

Molecular Formula

C24H29N5O2 (C24 H29 N5 O2)

Compound Name

3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3H,4H,6H,7H,8H,9H,10H-azepino[2,1-h]purin-4-one

IUPAC name

3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3H4H6H7H8H9H10H-azepino[21-h]purin-4-one

SMILES

O=C(CN(C=Nc1c2nc3n1CCCCC3)C2=O)N1CCC(Cc2ccccc2)CC1

InChI

InChI=1S/C24H29N5O2/c30-21(27-13-10-19(11-14-27)15-18-7-3-1-4-8-18)16-28-17-25-23-22(24(28)31)26-20-9-5-2-6-12-29(20)23/h1,3-4,7-8,17,19H,2,5-6,9-16H2

InChI Key

MPCCLNKWWVFWES-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.904

Distribution Coefficient, logD

2.903

Water Solubility, LogSw

-3.12

Polar Surface Area

55.249

Acid Dissociation Constant (pKa)

24.64

Base Dissociation Constant (pKb)

4.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with E714-0267F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E714-0267F?
Check Price and Availability of E714-0267F, 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 E714-0267F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E714-0267F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E714-0267F
  • 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 E714-0267F available by request