V020-6441 Screening compound: 1-(3-{3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-ethylurea

V020-6441 Screening compound: 1-(3-{3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-ethylurea
V020-6441 Screening compound: 1-(3-{3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-ethylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-6441
1-(3-{3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-ethylurea

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

V020-6441

Molecular Formula

C22H28N4O2 (C22 H28 N4 O2)

Compound Name

1-(3-{3-[(3,5-dimethylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-3-ethylurea

IUPAC name

1-(3-{3-[(35-dimethylphenyl)methyl]-2-oxo-13-diazinan-1-yl}phenyl)-3-ethylurea

SMILES

CCNC(Nc1cccc(N(CCCN2Cc3cc(C)cc(C)c3)C2=O)c1)=O

InChI

InChI=1S/C22H28N4O2/c1-4-23-21(27)24-19-7-5-8-20(14-19)26-10-6-9-25(22(26)28)15-18-12-16(2)11-17(3)13-18/h5,7-8,11-14H,4,6,9-10,15H2,1-3H3,(H2,23,24,27)

InChI Key

YVAFNVLOMKEBMJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19930897

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.710

Distribution Coefficient, logD

4.710

Water Solubility, LogSw

-4.33

Polar Surface Area

53.319

Acid Dissociation Constant (pKa)

12.95

Base Dissociation Constant (pKb)

1.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with V020-6441 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-6441?
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What is the minimum amount of V020-6441 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-6441
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-6441
  • 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 V020-6441 available by request