C909-0022 Screening compound: N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}-N'-(3,4,5-trimethoxyphenyl)ethanediamide

C909-0022 Screening compound: N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}-N'-(3,4,5-trimethoxyphenyl)ethanediamide
C909-0022 Screening compound: N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}-N'-(3,4,5-trimethoxyphenyl)ethanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C909-0022
N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}-N'-(3,4,5-trimethoxyphenyl)ethanediamide

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

C909-0022

Molecular Formula

C24H26N4O6 (C24 H26 N4 O6)

Compound Name

N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}-N'-(3,4,5-trimethoxyphenyl)ethanediamide

IUPAC name

N-{12-oxo-6H7H8H9H10H12H-azepino[21-b]quinazolin-2-yl}-N'-(345-trimethoxyphenyl)ethanediamide

SMILES

COc1cc(NC(C(Nc(cc2)cc3c2N=C(CCCCC2)N2C3=O)=O)=O)cc(OC)c1OC

InChI

InChI=1S/C24H26N4O6/c1-32-18-12-15(13-19(33-2)21(18)34-3)26-23(30)22(29)25-14-8-9-17-16(11-14)24(31)28-10-6-4-5-7-20(28)27-17/h8-9,11-13H,4-7,10H2,1-3H3,(H,25,29)(H,26,30)

InChI Key

LIVUOXMDWFGHGA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14807931

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.735

Distribution Coefficient, logD

1.363

Water Solubility, LogSw

-2.58

Polar Surface Area

96.152

Acid Dissociation Constant (pKa)

7.27

Base Dissociation Constant (pKb)

0.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

C909-0022 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C909-0022 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C909-0022?
Check Price and Availability of C909-0022, 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 C909-0022 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C909-0022
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C909-0022
  • 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 C909-0022 available by request