N038-0001 Screening compound: 8-(2,3-dihydroxy-3-methylbutoxy)-4-methoxy-1-methyl-1,2-dihydroquinolin-2-one

N038-0001 Screening compound: 8-(2,3-dihydroxy-3-methylbutoxy)-4-methoxy-1-methyl-1,2-dihydroquinolin-2-one
N038-0001 Screening compound: 8-(2,3-dihydroxy-3-methylbutoxy)-4-methoxy-1-methyl-1,2-dihydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound N038-0001
8-(2,3-dihydroxy-3-methylbutoxy)-4-methoxy-1-methyl-1,2-dihydroquinolin-2-one

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

N038-0001

Molecular Formula

C16H21NO5 (C16 H21 NO5)

Compound Name

8-(2,3-dihydroxy-3-methylbutoxy)-4-methoxy-1-methyl-1,2-dihydroquinolin-2-one

IUPAC name

8-[(2S)-23-dihydroxy-3-methylbutoxy]-4-methoxy-1-methyl-12-dihydroquinolin-2-one

SMILES

CC(C)(C(COc(cccc1C(OC)=C2)c1N(C)C2=O)O)O

InChI

InChI=1S/C16H21NO5/c1-16(2,20)13(18)9-22-11-7-5-6-10-12(21-4)8-14(19)17(3)15(10)11/h5-8,13,18,20H,9H2,1-4H3/t13-/m0/s1

InChI Key

IUPYLWAXGAJZQC-ZDUSSCGKSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

307.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.882

Distribution Coefficient, logD

0.882

Water Solubility, LogSw

-2.14

Polar Surface Area

63.506

Acid Dissociation Constant (pKa)

13.76

Base Dissociation Constant (pKb)

-2.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.75

N038-0001 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

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 N038-0001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound N038-0001?
Check Price and Availability of N038-0001, 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 N038-0001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for N038-0001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for N038-0001
  • 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 N038-0001 available by request