G411-0057 Screening compound: N-[4-(cyclohexylamino)-2-oxo-2H-chromen-3-yl]-3,4-dimethoxybenzene-1-sulfonamide

G411-0057 Screening compound: N-[4-(cyclohexylamino)-2-oxo-2H-chromen-3-yl]-3,4-dimethoxybenzene-1-sulfonamide
G411-0057 Screening compound: N-[4-(cyclohexylamino)-2-oxo-2H-chromen-3-yl]-3,4-dimethoxybenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G411-0057
N-[4-(cyclohexylamino)-2-oxo-2H-chromen-3-yl]-3,4-dimethoxybenzene-1-sulfonamide

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

G411-0057

Molecular Formula

C23H26N2O6S (C23 H26 N2 O6 S)

Compound Name

N-[4-(cyclohexylamino)-2-oxo-2H-chromen-3-yl]-3,4-dimethoxybenzene-1-sulfonamide

IUPAC name

N-[4-(cyclohexylamino)-2-oxo-2H-chromen-3-yl]-34-dimethoxybenzene-1-sulfonamide

SMILES

COc(ccc(S(NC(C(Oc1c2cccc1)=O)=C2NC1CCCCC1)(=O)=O)c1)c1OC

InChI

InChI=1S/C23H26N2O6S/c1-29-19-13-12-16(14-20(19)30-2)32(27,28)25-22-21(24-15-8-4-3-5-9-15)17-10-6-7-11-18(17)31-23(22)26/h6-7,10-15,24-25H,3-5,8-9H2,1-2H3

InChI Key

RODZVWWWCFOMSG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15010443

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.54

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.309

Distribution Coefficient, logD

0.201

Water Solubility, LogSw

-3.97

Polar Surface Area

87.428

Acid Dissociation Constant (pKa)

4.29

Base Dissociation Constant (pKb)

1.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

G411-0057 in Drug Discovery

Included in Screening Libraries

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 G411-0057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G411-0057?
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What is the minimum amount of G411-0057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G411-0057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G411-0057
  • 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 G411-0057 available by request