D300-0002 Screening compound: 5-({4-[(cyclohexylamino)methyl]phenoxy}methyl)-1,3-dimethyl-2,3-dihydro-1H-1,3-benzodiazol-2-one

D300-0002 Screening compound: 5-({4-[(cyclohexylamino)methyl]phenoxy}methyl)-1,3-dimethyl-2,3-dihydro-1H-1,3-benzodiazol-2-one
D300-0002 Screening compound: 5-({4-[(cyclohexylamino)methyl]phenoxy}methyl)-1,3-dimethyl-2,3-dihydro-1H-1,3-benzodiazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D300-0002
5-({4-[(cyclohexylamino)methyl]phenoxy}methyl)-1,3-dimethyl-2,3-dihydro-1H-1,3-benzodiazol-2-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

D300-0002

Molecular Formula

C23H29N3O2 (C23 H29 N3 O2)

Compound Name

5-({4-[(cyclohexylamino)methyl]phenoxy}methyl)-1,3-dimethyl-2,3-dihydro-1H-1,3-benzodiazol-2-one

IUPAC name

5-({4-[(cyclohexylamino)methyl]phenoxy}methyl)-13-dimethyl-23-dihydro-1H-13-benzodiazol-2-one

SMILES

CN(c(ccc(COc1ccc(CNC2CCCCC2)cc1)c1)c1N1C)C1=O

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

379.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.793

Distribution Coefficient, logD

1.607

Water Solubility, LogSw

-3.98

Polar Surface Area

36.433

Acid Dissociation Constant (pKa)

26.77

Base Dissociation Constant (pKb)

9.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

D300-0002 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D300-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D300-0002?
Check Price and Availability of D300-0002, 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 D300-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D300-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D300-0002
  • 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 D300-0002 available by request