V003-2719 Screening compound: 1-[(2H-1,3-benzodioxol-5-yl)methyl]-3-tert-butyl-1-{[5-(2,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}urea

V003-2719 Screening compound: 1-[(2H-1,3-benzodioxol-5-yl)methyl]-3-tert-butyl-1-{[5-(2,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}urea
V003-2719 Screening compound: 1-[(2H-1,3-benzodioxol-5-yl)methyl]-3-tert-butyl-1-{[5-(2,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-2719
1-[(2H-1,3-benzodioxol-5-yl)methyl]-3-tert-butyl-1-{[5-(2,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}urea

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

V003-2719

Molecular Formula

C25H29N3O6 (C25 H29 N3 O6)

Compound Name

1-[(2H-1,3-benzodioxol-5-yl)methyl]-3-tert-butyl-1-{[5-(2,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}urea

IUPAC name

1-[(2H-13-benzodioxol-5-yl)methyl]-3-tert-butyl-1-{[5-(24-dimethoxyphenyl)-12-oxazol-3-yl]methyl}urea

SMILES

CC(C)(C)NC(N(Cc1noc(-c(ccc(OC)c2)c2OC)c1)Cc(cc1)cc2c1OCO2)=O

InChI

InChI=1S/C25H29N3O6/c1-25(2,3)26-24(29)28(13-16-6-9-20-23(10-16)33-15-32-20)14-17-11-22(34-27-17)19-8-7-18(30-4)12-21(19)31-5/h6-12H,13-15H2,1-5H3,(H,26,29)

InChI Key

YFIWEYMWOKEGEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19815004

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.627

Distribution Coefficient, logD

4.627

Water Solubility, LogSw

-4.45

Polar Surface Area

79.736

Acid Dissociation Constant (pKa)

16.86

Base Dissociation Constant (pKb)

1.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

References: we are preparing a list of scientific research reports with V003-2719 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-2719?
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What is the minimum amount of V003-2719 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-2719
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-2719
  • 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 V003-2719 available by request