P079-0155 Screening compound: 1-{imidazo[1,2-a]pyrazine-2-carbonyl}azepane

P079-0155 Screening compound: 1-{imidazo[1,2-a]pyrazine-2-carbonyl}azepane
P079-0155 Screening compound: 1-{imidazo[1,2-a]pyrazine-2-carbonyl}azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound P079-0155
1-{imidazo[1,2-a]pyrazine-2-carbonyl}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

P079-0155

Molecular Formula

C13H16N4O (C13 H16 N4 O)

Compound Name

1-{imidazo[1,2-a]pyrazine-2-carbonyl}azepane

IUPAC name

1-{imidazo[12-a]pyrazine-2-carbonyl}azepane

SMILES

O=C(c1cn(ccnc2)c2n1)N1CCCCCC1

InChI

InChI=1S/C13H16N4O/c18-13(16-6-3-1-2-4-7-16)11-10-17-8-5-14-9-12(17)15-11/h5,8-10H,1-4,6-7H2

InChI Key

SDURTOVGWHCEJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27563306

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

244.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.363

Distribution Coefficient, logD

1.363

Water Solubility, LogSw

-1.42

Polar Surface Area

36.402

Acid Dissociation Constant (pKa)

27.95

Base Dissociation Constant (pKb)

2.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.15

P079-0155 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P079-0155 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P079-0155?
Check Price and Availability of P079-0155, 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 P079-0155 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P079-0155
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P079-0155
  • 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 P079-0155 available by request