C660-0322 Screening compound: 2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}acetamide

C660-0322 Screening compound: 2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}acetamide
C660-0322 Screening compound: 2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C660-0322
2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}acetamide

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

C660-0322

Molecular Formula

C25H26ClN5O3 (C25 H26 ClN5 O3)

Compound Name

2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}acetamide

IUPAC name

2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-N-{12-oxo-6H7H8H9H10H12H-azepino[21-b]quinazolin-2-yl}acetamide

SMILES

O=C(C(N(CC1)CCN1c1cccc(Cl)c1)=O)Nc(cc1)cc2c1N=C(CCCCC1)N1C2=O

InChI

InChI=1S/C25H26ClN5O3/c26-17-5-4-6-19(15-17)29-11-13-30(14-12-29)25(34)23(32)27-18-8-9-21-20(16-18)24(33)31-10-3-1-2-7-22(31)28-21/h4-6,8-9,15-16H,1-3,7,10-14H2,(H,27,32)

InChI Key

MSZASTWEVDWIHE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14780043

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.97

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.989

Distribution Coefficient, logD

2.438

Water Solubility, LogSw

-3.80

Polar Surface Area

69.991

Acid Dissociation Constant (pKa)

6.99

Base Dissociation Constant (pKb)

3.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

C660-0322 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C660-0322 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C660-0322?
Check Price and Availability of C660-0322, 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 C660-0322 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C660-0322
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C660-0322
  • 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 C660-0322 available by request