D144-0587 Screening compound: ethyl 3-{3-[(4-methoxyphenyl)methyl]-6,10-dimethyl-8-oxo-2H,3H,4H,8H-chromeno[6,7-e][1,3]oxazin-7-yl}propanoate

D144-0587 Screening compound: ethyl 3-{3-[(4-methoxyphenyl)methyl]-6,10-dimethyl-8-oxo-2H,3H,4H,8H-chromeno[6,7-e][1,3]oxazin-7-yl}propanoate
D144-0587 Screening compound: ethyl 3-{3-[(4-methoxyphenyl)methyl]-6,10-dimethyl-8-oxo-2H,3H,4H,8H-chromeno[6,7-e][1,3]oxazin-7-yl}propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D144-0587
ethyl 3-{3-[(4-methoxyphenyl)methyl]-6,10-dimethyl-8-oxo-2H,3H,4H,8H-chromeno[6,7-e][1,3]oxazin-7-yl}propanoate

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

D144-0587

Molecular Formula

C26H29NO6 (C26 H29 NO6)

Compound Name

ethyl 3-{3-[(4-methoxyphenyl)methyl]-6,10-dimethyl-8-oxo-2H,3H,4H,8H-chromeno[6,7-e][1,3]oxazin-7-yl}propanoate

IUPAC name

ethyl 3-{3-[(4-methoxyphenyl)methyl]-610-dimethyl-8-oxo-2H3H4H8H-chromeno[67-e][13]oxazin-7-yl}propanoate

SMILES

CCOC(CCC1=C(C)c(cc(CN(Cc(cc2)ccc2OC)CO2)c2c2C)c2OC1=O)=O

InChI

InChI=1S/C26H29NO6/c1-5-31-23(28)11-10-21-16(2)22-12-19-14-27(13-18-6-8-20(30-4)9-7-18)15-32-24(19)17(3)25(22)33-26(21)29/h6-9,12H,5,10-11,13-15H2,1-4H3

InChI Key

NRRVOIJHTBYACH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06439335

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.817

Distribution Coefficient, logD

4.182

Water Solubility, LogSw

-4.61

Polar Surface Area

60.816

Acid Dissociation Constant (pKa)

23.48

Base Dissociation Constant (pKb)

7.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with D144-0587 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D144-0587?
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What is the minimum amount of D144-0587 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D144-0587
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D144-0587
  • 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 D144-0587 available by request