K679-0098 Screening compound: N-butyl-N,1-diethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxamide

K679-0098 Screening compound: N-butyl-N,1-diethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxamide
K679-0098 Screening compound: N-butyl-N,1-diethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K679-0098
N-butyl-N,1-diethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxamide

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

K679-0098

Molecular Formula

C18H25N3O2 (C18 H25 N3 O2)

Compound Name

N-butyl-N,1-diethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxamide

IUPAC name

N-butyl-N1-diethyl-7-methyl-4-oxo-14-dihydro-18-naphthyridine-3-carboxamide

SMILES

CCCCN(CC)C(C1=CN(CC)c(nc(C)cc2)c2C1=O)=O

InChI

InChI=1S/C18H25N3O2/c1-5-8-11-20(6-2)18(23)15-12-21(7-3)17-14(16(15)22)10-9-13(4)19-17/h9-10,12H,5-8,11H2,1-4H3

InChI Key

VTFXDIVELBWGQW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02936346

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.588

Distribution Coefficient, logD

3.588

Water Solubility, LogSw

-3.59

Polar Surface Area

41.450

Acid Dissociation Constant (pKa)

27.70

Base Dissociation Constant (pKb)

2.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

K679-0098 in Drug Discovery

Included in Screening Libraries

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

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with K679-0098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K679-0098?
Check Price and Availability of K679-0098, 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 K679-0098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K679-0098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K679-0098
  • 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 K679-0098 available by request