3284-1669 Screening compound: 1-(adamantan-1-yl)-3-[(E)-[(2H-1,3-benzodioxol-5-yl)methylidene]amino]urea

3284-1669 Screening compound: 1-(adamantan-1-yl)-3-[(E)-[(2H-1,3-benzodioxol-5-yl)methylidene]amino]urea
3284-1669 Screening compound: 1-(adamantan-1-yl)-3-[(E)-[(2H-1,3-benzodioxol-5-yl)methylidene]amino]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 3284-1669
1-(adamantan-1-yl)-3-[(E)-[(2H-1,3-benzodioxol-5-yl)methylidene]amino]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

3284-1669

Molecular Formula

C19H23N3O3 (C19 H23 N3 O3)

Compound Name

1-(adamantan-1-yl)-3-[(E)-[(2H-1,3-benzodioxol-5-yl)methylidene]amino]urea

IUPAC name

1-(adamantan-1-yl)-3-[(E)-[(2H-13-benzodioxol-5-yl)methylidene]amino]urea

SMILES

O=C(NC1(CC(C2)C3)CC3CC2C1)N/N=C/c(cc1)cc2c1OCO2

InChI

InChI=1S/C19H23N3O3/c23-18(21-19-7-13-3-14(8-19)5-15(4-13)9-19)22-20-10-12-1-2-16-17(6-12)25-11-24-16/h1-2,6,10,13-15H,3-5,7-9,11H2,(H2,21,22,23)

InChI Key

VAOGDOUJNDDIFH-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.182

Distribution Coefficient, logD

4.182

Water Solubility, LogSw

-4.39

Polar Surface Area

62.899

Acid Dissociation Constant (pKa)

12.91

Base Dissociation Constant (pKb)

-3.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

References: we are preparing a list of scientific research reports with 3284-1669 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3284-1669?
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What is the minimum amount of 3284-1669 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3284-1669
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3284-1669
  • 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 3284-1669 available by request