C803-0295 Screening compound: 3,4-dimethoxy-N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}benzamide

C803-0295 Screening compound: 3,4-dimethoxy-N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}benzamide
C803-0295 Screening compound: 3,4-dimethoxy-N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C803-0295
3,4-dimethoxy-N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}benzamide

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

C803-0295

Molecular Formula

C22H23N3O4 (C22 H23 N3 O4)

Compound Name

3,4-dimethoxy-N-{12-oxo-6H,7H,8H,9H,10H,12H-azepino[2,1-b]quinazolin-2-yl}benzamide

IUPAC name

34-dimethoxy-N-{12-oxo-6H7H8H9H10H12H-azepino[21-b]quinazolin-2-yl}benzamide

SMILES

COc(ccc(C(Nc(cc1)cc2c1N=C(CCCCC1)N1C2=O)=O)c1)c1OC

InChI

InChI=1S/C22H23N3O4/c1-28-18-10-7-14(12-19(18)29-2)21(26)23-15-8-9-17-16(13-15)22(27)25-11-5-3-4-6-20(25)24-17/h7-10,12-13H,3-6,11H2,1-2H3,(H,23,26)

InChI Key

OUPZONMODOVICY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14800078

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.566

Distribution Coefficient, logD

2.565

Water Solubility, LogSw

-3.18

Polar Surface Area

65.072

Acid Dissociation Constant (pKa)

11.61

Base Dissociation Constant (pKb)

3.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

C803-0295 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 C803-0295 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C803-0295?
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What is the minimum amount of C803-0295 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C803-0295
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C803-0295
  • 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 C803-0295 available by request