D670-0109 Screening compound: 2-[(4-ethylphenoxy)methyl]-5,7-dimethyl-1H-1,3-benzodiazole

D670-0109 Screening compound: 2-[(4-ethylphenoxy)methyl]-5,7-dimethyl-1H-1,3-benzodiazole
D670-0109 Screening compound: 2-[(4-ethylphenoxy)methyl]-5,7-dimethyl-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D670-0109
2-[(4-ethylphenoxy)methyl]-5,7-dimethyl-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

D670-0109

Molecular Formula

C18H20N2O (C18 H20 N2 O)

Compound Name

2-[(4-ethylphenoxy)methyl]-5,7-dimethyl-1H-1,3-benzodiazole

IUPAC name

2-[(4-ethylphenoxy)methyl]-57-dimethyl-1H-13-benzodiazole

SMILES

CCc(cc1)ccc1OCc1nc(cc(C)cc2C)c2[nH]1

InChI

InChI=1S/C18H20N2O/c1-4-14-5-7-15(8-6-14)21-11-17-19-16-10-12(2)9-13(3)18(16)20-17/h5-10H,4,11H2,1-3H3,(H,19,20)

InChI Key

LHZUBJHDHCIHPD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27595515

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

280.37

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.141

Distribution Coefficient, logD

5.140

Water Solubility, LogSw

-5.05

Polar Surface Area

28.518

Acid Dissociation Constant (pKa)

14.47

Base Dissociation Constant (pKb)

4.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

D670-0109 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D670-0109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D670-0109?
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What is the minimum amount of D670-0109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D670-0109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D670-0109
  • 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 D670-0109 available by request