D277-1690 Screening compound: 1-[2-(2,3-dimethylphenoxy)ethyl]-2,5,6-trimethyl-1H-1,3-benzodiazole

D277-1690 Screening compound: 1-[2-(2,3-dimethylphenoxy)ethyl]-2,5,6-trimethyl-1H-1,3-benzodiazole
D277-1690 Screening compound: 1-[2-(2,3-dimethylphenoxy)ethyl]-2,5,6-trimethyl-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D277-1690
1-[2-(2,3-dimethylphenoxy)ethyl]-2,5,6-trimethyl-1H-1,3-benzodiazole

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

D277-1690

Molecular Formula

C20H24N2O (C20 H24 N2 O)

Compound Name

1-[2-(2,3-dimethylphenoxy)ethyl]-2,5,6-trimethyl-1H-1,3-benzodiazole

IUPAC name

1-[2-(23-dimethylphenoxy)ethyl]-256-trimethyl-1H-13-benzodiazole

SMILES

Cc1nc(cc(C)c(C)c2)c2n1CCOc1c(C)c(C)ccc1

InChI

InChI=1S/C20H24N2O/c1-13-7-6-8-20(16(13)4)23-10-9-22-17(5)21-18-11-14(2)15(3)12-19(18)22/h6-8,11-12H,9-10H2,1-5H3

InChI Key

ITDURCBJCQTFJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08163136

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.42

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.559

Distribution Coefficient, logD

5.558

Water Solubility, LogSw

-5.54

Polar Surface Area

18.427

Acid Dissociation Constant (pKa)

23.66

Base Dissociation Constant (pKb)

4.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

D277-1690 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular

References: we are preparing a list of scientific research reports with D277-1690 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D277-1690?
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What is the minimum amount of D277-1690 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D277-1690
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D277-1690
  • 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 D277-1690 available by request