P578-1827 Screening compound: 1-{1-[6-(morpholin-4-yl)pyrimidin-4-yl]-1H-imidazole-4-carbonyl}azepane

P578-1827 Screening compound: 1-{1-[6-(morpholin-4-yl)pyrimidin-4-yl]-1H-imidazole-4-carbonyl}azepane
P578-1827 Screening compound: 1-{1-[6-(morpholin-4-yl)pyrimidin-4-yl]-1H-imidazole-4-carbonyl}azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound P578-1827
1-{1-[6-(morpholin-4-yl)pyrimidin-4-yl]-1H-imidazole-4-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

P578-1827

Molecular Formula

C18H24N6O2 (C18 H24 N6 O2)

Compound Name

1-{1-[6-(morpholin-4-yl)pyrimidin-4-yl]-1H-imidazole-4-carbonyl}azepane

IUPAC name

1-{1-[6-(morpholin-4-yl)pyrimidin-4-yl]-1H-imidazole-4-carbonyl}azepane

SMILES

O=C(c(nc1)cn1-c1ncnc(N2CCOCC2)c1)N1CCCCCC1

InChI

InChI=1S/C18H24N6O2/c25-18(23-5-3-1-2-4-6-23)15-12-24(14-21-15)17-11-16(19-13-20-17)22-7-9-26-10-8-22/h11-14H,1-10H2

InChI Key

AALMSKFEMPEWQJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27605470

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.650

Distribution Coefficient, logD

2.649

Water Solubility, LogSw

-2.75

Polar Surface Area

59.554

Acid Dissociation Constant (pKa)

23.11

Base Dissociation Constant (pKb)

4.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.60

P578-1827 in Drug Discovery

Included in Screening Libraries

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

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with P578-1827 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P578-1827?
Check Price and Availability of P578-1827, 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 P578-1827 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P578-1827
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P578-1827
  • 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 P578-1827 available by request