Y040-1438 Screening compound: N-cyclohexyl-2-({8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl}oxy)-N-methylacetamide

Y040-1438 Screening compound: N-cyclohexyl-2-({8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl}oxy)-N-methylacetamide
Y040-1438 Screening compound: N-cyclohexyl-2-({8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl}oxy)-N-methylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-1438
N-cyclohexyl-2-({8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl}oxy)-N-methylacetamide

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

Y040-1438

Molecular Formula

C23H25NO5 (C23 H25 NO5)

Compound Name

N-cyclohexyl-2-({8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl}oxy)-N-methylacetamide

IUPAC name

N-cyclohexyl-2-({8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl}oxy)-N-methylacetamide

SMILES

CN(C1CCCCC1)C(COc(cc1)cc(O2)c1-c(ccc(OC)c1)c1C2=O)=O

InChI

InChI=1S/C23H25NO5/c1-24(15-6-4-3-5-7-15)22(25)14-28-17-9-11-19-18-10-8-16(27-2)12-20(18)23(26)29-21(19)13-17/h8-13,15H,3-7,14H2,1-2H3

InChI Key

BKMXZCPSDYPWAQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06763512

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.779

Distribution Coefficient, logD

3.779

Water Solubility, LogSw

-5.09

Polar Surface Area

50.606

Acid Dissociation Constant (pKa)

25.23

Base Dissociation Constant (pKb)

5.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

Y040-1438 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y040-1438 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-1438?
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What is the minimum amount of Y040-1438 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-1438
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-1438
  • 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 Y040-1438 available by request