G668-0608 Screening compound: N-{2-[cyclohexyl(methyl)amino]ethyl}-6-methoxy-3,4-dihydro-2H-1-benzopyran-3-carboxamide

G668-0608 Screening compound: N-{2-[cyclohexyl(methyl)amino]ethyl}-6-methoxy-3,4-dihydro-2H-1-benzopyran-3-carboxamide
G668-0608 Screening compound: N-{2-[cyclohexyl(methyl)amino]ethyl}-6-methoxy-3,4-dihydro-2H-1-benzopyran-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G668-0608
N-{2-[cyclohexyl(methyl)amino]ethyl}-6-methoxy-3,4-dihydro-2H-1-benzopyran-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

G668-0608

Molecular Formula

C20H30N2O3 (C20 H30 N2 O3)

Compound Name

N-{2-[cyclohexyl(methyl)amino]ethyl}-6-methoxy-3,4-dihydro-2H-1-benzopyran-3-carboxamide

IUPAC name

N-{2-[cyclohexyl(methyl)amino]ethyl}-6-methoxy-34-dihydro-2H-1-benzopyran-3-carboxamide

SMILES

CN(CCNC(C(C1)COc(cc2)c1cc2OC)=O)C1CCCCC1

InChI

InChI=1S/C20H30N2O3/c1-22(17-6-4-3-5-7-17)11-10-21-20(23)16-12-15-13-18(24-2)8-9-19(15)25-14-16/h8-9,13,16-17H,3-7,10-12,14H2,1-2H3,(H,21,23)/t16-/m0/s1

InChI Key

OVPNXWPNWMOBEK-INIZCTEOSA-N

MDL Number (MFCD)

MFCD15027820

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.049

Distribution Coefficient, logD

1.312

Water Solubility, LogSw

-3.13

Polar Surface Area

43.445

Acid Dissociation Constant (pKa)

12.73

Base Dissociation Constant (pKb)

9.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

65.00

G668-0608 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

CNS BBB Library (22607 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system

References: we are preparing a list of scientific research reports with G668-0608 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G668-0608?
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What is the minimum amount of G668-0608 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G668-0608
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G668-0608
  • 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 G668-0608 available by request