Y040-3815 Screening compound: 9-(2-methoxyphenethyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one

Y040-3815 Screening compound: 9-(2-methoxyphenethyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one
Y040-3815 Screening compound: 9-(2-methoxyphenethyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-3815
9-(2-methoxyphenethyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one

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

Y040-3815

Molecular Formula

C24H25NO4 (C24 H25 NO4)

Compound Name

9-(2-methoxyphenethyl)-6-methyl-2,3,9,10-tetrahydro-8H-cyclopenta[3,4]chromeno[6,7-e][1,3]oxazin-4(1H)-one

IUPAC name

6-[2-(2-methoxyphenyl)ethyl]-2-methyl-417-dioxa-6-azatetracyclo[8.7.0.0^{38}.0^{1115}]heptadeca-13(8)911(15)-tetraen-16-one

SMILES

Cc1c2OCN(CCc(cccc3)c3OC)Cc2cc(C2=C3CCC2)c1OC3=O

InChI

InChI=1S/C24H25NO4/c1-15-22-17(12-20-18-7-5-8-19(18)24(26)29-23(15)20)13-25(14-28-22)11-10-16-6-3-4-9-21(16)27-2/h3-4,6,9,12H,5,7-8,10-11,13-14H2,1-2H3

InChI Key

RTEXNWUBFGFKCK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06439430

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.482

Distribution Coefficient, logD

2.639

Water Solubility, LogSw

-4.38

Polar Surface Area

41.008

Acid Dissociation Constant (pKa)

24.14

Base Dissociation Constant (pKb)

9.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

Y040-3815 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y040-3815 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-3815?
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What is the minimum amount of Y040-3815 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-3815
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-3815
  • 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 Y040-3815 available by request