C248-0222 Screening compound: N-{3-cyclohexyl-2,4-dioxo-1H,2H,3H,4H-benzo[g]pteridin-8-yl}nonanamide

C248-0222 Screening compound: N-{3-cyclohexyl-2,4-dioxo-1H,2H,3H,4H-benzo[g]pteridin-8-yl}nonanamide
C248-0222 Screening compound: N-{3-cyclohexyl-2,4-dioxo-1H,2H,3H,4H-benzo[g]pteridin-8-yl}nonanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C248-0222
N-{3-cyclohexyl-2,4-dioxo-1H,2H,3H,4H-benzo[g]pteridin-8-yl}nonanamide

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

C248-0222

Molecular Formula

C25H33N5O3 (C25 H33 N5 O3)

Compound Name

N-{3-cyclohexyl-2,4-dioxo-1H,2H,3H,4H-benzo[g]pteridin-8-yl}nonanamide

IUPAC name

N-{3-cyclohexyl-24-dioxo-1H2H3H4H-benzo[g]pteridin-8-yl}nonanamide

SMILES

CCCCCCCCC(Nc(cc1nc2NC(N3C4CCCCC4)=O)ccc1nc2C3=O)=O

InChI

InChI=1S/C25H33N5O3/c1-2-3-4-5-6-10-13-21(31)26-17-14-15-19-20(16-17)28-23-22(27-19)24(32)30(25(33)29-23)18-11-8-7-9-12-18/h14-16,18H,2-13H2,1H3,(H,26,31)(H,28,29,33)

InChI Key

SSHAWZFHMIHFKG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14735254

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.805

Distribution Coefficient, logD

5.792

Water Solubility, LogSw

-5.30

Polar Surface Area

81.221

Acid Dissociation Constant (pKa)

8.93

Base Dissociation Constant (pKb)

2.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.00

C248-0222 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with C248-0222 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C248-0222?
Check Price and Availability of C248-0222, 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 C248-0222 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C248-0222
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C248-0222
  • 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 C248-0222 available by request