7599-1572 Screening compound: (3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl 3,4-dimethoxybenzoate

7599-1572 Screening compound: (3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl 3,4-dimethoxybenzoate
7599-1572 Screening compound: (3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl 3,4-dimethoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7599-1572
(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl 3,4-dimethoxybenzoate

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

7599-1572

Molecular Formula

C19H19NO5 (C19 H19 NO5)

Compound Name

(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl 3,4-dimethoxybenzoate

IUPAC name

(3-phenyl-45-dihydro-12-oxazol-5-yl)methyl 34-dimethoxybenzoate

SMILES

COc(ccc(C(OCC(C1)ON=C1c1ccccc1)=O)c1)c1OC

InChI

InChI=1S/C19H19NO5/c1-22-17-9-8-14(10-18(17)23-2)19(21)24-12-15-11-16(20-25-15)13-6-4-3-5-7-13/h3-10,15H,11-12H2,1-2H3/t15-/m1/s1

InChI Key

RMXFSYCDDXGVOI-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD06605435

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.438

Distribution Coefficient, logD

3.438

Water Solubility, LogSw

-3.67

Polar Surface Area

59.193

Acid Dissociation Constant (pKa)

22.13

Base Dissociation Constant (pKb)

-1.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.30

7599-1572 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antimitotic Tubulin Library (17355 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with 7599-1572 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7599-1572?
Check Price and Availability of 7599-1572, 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 7599-1572 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7599-1572
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7599-1572
  • 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 7599-1572 available by request