G669-0131 Screening compound: 6-methoxy-N-(3-methylbutyl)-2H-chromene-3-carboxamide

G669-0131 Screening compound: 6-methoxy-N-(3-methylbutyl)-2H-chromene-3-carboxamide
G669-0131 Screening compound: 6-methoxy-N-(3-methylbutyl)-2H-chromene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G669-0131
6-methoxy-N-(3-methylbutyl)-2H-chromene-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

G669-0131

Molecular Formula

C16H21NO3 (C16 H21 NO3)

Compound Name

6-methoxy-N-(3-methylbutyl)-2H-chromene-3-carboxamide

IUPAC name

6-methoxy-N-(3-methylbutyl)-2H-chromene-3-carboxamide

SMILES

CC(C)CCNC(C1=Cc(cc(cc2)OC)c2OC1)=O

InChI

InChI=1S/C16H21NO3/c1-11(2)6-7-17-16(18)13-8-12-9-14(19-3)4-5-15(12)20-10-13/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,17,18)

InChI Key

JLULDNAWXRPYHT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15027883

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

275.35

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.247

Distribution Coefficient, logD

3.247

Water Solubility, LogSw

-3.57

Polar Surface Area

40.679

Acid Dissociation Constant (pKa)

14.56

Base Dissociation Constant (pKb)

1.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

G669-0131 in Drug Discovery

Included in Screening Libraries

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

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with G669-0131 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G669-0131?
Check Price and Availability of G669-0131, 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 G669-0131 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G669-0131
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G669-0131
  • 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 G669-0131 available by request