C248-0275 Screening compound: N-{3-cycloheptyl-7-methyl-2,4-dioxo-1H,2H,3H,4H-benzo[g]pteridin-8-yl}propanamide

C248-0275 Screening compound: N-{3-cycloheptyl-7-methyl-2,4-dioxo-1H,2H,3H,4H-benzo[g]pteridin-8-yl}propanamide
C248-0275 Screening compound: N-{3-cycloheptyl-7-methyl-2,4-dioxo-1H,2H,3H,4H-benzo[g]pteridin-8-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C248-0275
N-{3-cycloheptyl-7-methyl-2,4-dioxo-1H,2H,3H,4H-benzo[g]pteridin-8-yl}propanamide

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

C248-0275

Molecular Formula

C21H25N5O3 (C21 H25 N5 O3)

Compound Name

N-{3-cycloheptyl-7-methyl-2,4-dioxo-1H,2H,3H,4H-benzo[g]pteridin-8-yl}propanamide

IUPAC name

N-{3-cycloheptyl-7-methyl-24-dioxo-1H2H3H4H-benzo[g]pteridin-8-yl}propanamide

SMILES

CCC(Nc(cc1nc2NC(N3C4CCCCCC4)=O)c(C)cc1nc2C3=O)=O

InChI

InChI=1S/C21H25N5O3/c1-3-17(27)22-14-11-16-15(10-12(14)2)23-18-19(24-16)25-21(29)26(20(18)28)13-8-6-4-5-7-9-13/h10-11,13H,3-9H2,1-2H3,(H,22,27)(H,24,25,29)

InChI Key

YPCZZTBCJKIHDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09697384

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.267

Distribution Coefficient, logD

3.254

Water Solubility, LogSw

-3.27

Polar Surface Area

80.854

Acid Dissociation Constant (pKa)

8.93

Base Dissociation Constant (pKb)

1.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.62

C248-0275 in Drug Discovery

Included in Screening Libraries

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

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C248-0275 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C248-0275?
Check Price and Availability of C248-0275, 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 C248-0275 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C248-0275
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C248-0275
  • 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 C248-0275 available by request