D305-1267 Screening compound: 2-(4-tert-butylphenoxy)-N-{1-ethyl-2-[(piperidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}acetamide

D305-1267 Screening compound: 2-(4-tert-butylphenoxy)-N-{1-ethyl-2-[(piperidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}acetamide
D305-1267 Screening compound: 2-(4-tert-butylphenoxy)-N-{1-ethyl-2-[(piperidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D305-1267
2-(4-tert-butylphenoxy)-N-{1-ethyl-2-[(piperidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}acetamide

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

D305-1267

Molecular Formula

C27H36N4O2 (C27 H36 N4 O2)

Compound Name

2-(4-tert-butylphenoxy)-N-{1-ethyl-2-[(piperidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}acetamide

IUPAC name

2-(4-tert-butylphenoxy)-N-{1-ethyl-2-[(piperidin-1-yl)methyl]-1H-13-benzodiazol-5-yl}acetamide

SMILES

CCn1c(ccc(NC(COc2ccc(C(C)(C)C)cc2)=O)c2)c2nc1CN1CCCCC1

InChI

InChI=1S/C27H36N4O2/c1-5-31-24-14-11-21(17-23(24)29-25(31)18-30-15-7-6-8-16-30)28-26(32)19-33-22-12-9-20(10-13-22)27(2,3)4/h9-14,17H,5-8,15-16,18-19H2,1-4H3,(H,28,32)

InChI Key

DGLPBXUTFSJKRO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14817841

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.772

Distribution Coefficient, logD

5.582

Water Solubility, LogSw

-5.33

Polar Surface Area

45.249

Acid Dissociation Constant (pKa)

12.44

Base Dissociation Constant (pKb)

7.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.10

D305-1267 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

MCL1 Targeted Library (12200 compounds)

Selective Target Activity Profiling Library (14702 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:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with D305-1267 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D305-1267?
Check Price and Availability of D305-1267, 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 D305-1267 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D305-1267
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D305-1267
  • 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 D305-1267 available by request