D144-0361 Screening compound: 11-chloro-3-(4-fluorophenethyl)-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-one

D144-0361 Screening compound: 11-chloro-3-(4-fluorophenethyl)-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-one
D144-0361 Screening compound: 11-chloro-3-(4-fluorophenethyl)-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D144-0361
11-chloro-3-(4-fluorophenethyl)-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-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

D144-0361

Molecular Formula

C22H19ClFNO3 (C22 H19 ClFNO3)

Compound Name

11-chloro-3-(4-fluorophenethyl)-3,4,8,9-tetrahydro-2H-cyclopenta[3,4]chromeno[8,7-e][1,3]oxazin-6(7H)-one

IUPAC name

8-chloro-4-[2-(4-fluorophenyl)ethyl]-617-dioxa-4-azatetracyclo[8.7.0.0^{27}.0^{1115}]heptadeca-17911(15)-tetraen-16-one

SMILES

O=C(C(CCC1)=C1c1c2)Oc1c(CN(CCc(cc1)ccc1F)CO1)c1c2Cl

InChI

InChI=1S/C22H19ClFNO3/c23-19-10-17-15-2-1-3-16(15)22(26)28-20(17)18-11-25(12-27-21(18)19)9-8-13-4-6-14(24)7-5-13/h4-7,10H,1-3,8-9,11-12H2

InChI Key

GCXDWXCOUNDXJB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05702551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.85

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.925

Distribution Coefficient, logD

4.773

Water Solubility, LogSw

-5.04

Polar Surface Area

33.378

Acid Dissociation Constant (pKa)

23.91

Base Dissociation Constant (pKb)

7.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

D144-0361 in Drug Discovery

Included in Screening Libraries

Steroid-like Compounds (494 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • Immune system
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with D144-0361 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D144-0361?
Check Price and Availability of D144-0361, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D144-0361 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D144-0361
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D144-0361
  • 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 D144-0361 available by request