C909-0248 Screening compound: N~1~-[3-(2-methylpiperidino)propyl]-N~2~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)ethanediamide

C909-0248 Screening compound: N~1~-[3-(2-methylpiperidino)propyl]-N~2~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)ethanediamide
C909-0248 Screening compound: N~1~-[3-(2-methylpiperidino)propyl]-N~2~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)ethanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C909-0248
N~1~-[3-(2-methylpiperidino)propyl]-N~2~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)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

C909-0248

Molecular Formula

C24H33N5O3 (C24 H33 N5 O3)

Compound Name

N~1~-[3-(2-methylpiperidino)propyl]-N~2~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)ethanediamide

IUPAC name

n/a

SMILES

CC1N(CCCNC(C(Nc(cc2)cc3c2N=C(CCCCC2)N2C3=O)=O)=O)CCCC1

InChI

InChI=1S/C24H33N5O3/c1-17-8-4-6-13-28(17)14-7-12-25-22(30)23(31)26-18-10-11-20-19(16-18)24(32)29-15-5-2-3-9-21(29)27-20/h10-11,16-17H,2-9,12-15H2,1H3,(H,25,30)(H,26,31)/t17-/m0/s1

InChI Key

ANIVOIHUXCSCBG-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD14808033

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.561

Distribution Coefficient, logD

-1.288

Water Solubility, LogSw

-2.49

Polar Surface Area

77.771

Acid Dissociation Constant (pKa)

7.51

Base Dissociation Constant (pKb)

10.25

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

58.30

C909-0248 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C909-0248 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C909-0248?
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What is the minimum amount of C909-0248 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C909-0248
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C909-0248
  • 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 C909-0248 available by request