8019-2238 Screening compound: 1-{1-[3-(4-ethylphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}propan-1-ol

8019-2238 Screening compound: 1-{1-[3-(4-ethylphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}propan-1-ol
8019-2238 Screening compound: 1-{1-[3-(4-ethylphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}propan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-2238
1-{1-[3-(4-ethylphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}propan-1-ol

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

8019-2238

Molecular Formula

C21H26N2O2 (C21 H26 N2 O2)

Compound Name

1-{1-[3-(4-ethylphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}propan-1-ol

IUPAC name

1-{1-[3-(4-ethylphenoxy)propyl]-1H-13-benzodiazol-2-yl}propan-1-ol

SMILES

CCC(c1nc(cccc2)c2n1CCCOc1ccc(CC)cc1)O

InChI

InChI=1S/C21H26N2O2/c1-3-16-10-12-17(13-11-16)25-15-7-14-23-19-9-6-5-8-18(19)22-21(23)20(24)4-2/h5-6,8-13,20,24H,3-4,7,14-15H2,1-2H3/t20-/m0/s1

InChI Key

YNWWOYWTDBHQHP-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD07394730

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.112

Distribution Coefficient, logD

5.110

Water Solubility, LogSw

-4.79

Polar Surface Area

33.715

Acid Dissociation Constant (pKa)

14.91

Base Dissociation Constant (pKb)

4.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

8019-2238 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 8019-2238 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-2238?
Check Price and Availability of 8019-2238, 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 8019-2238 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-2238
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-2238
  • 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 8019-2238 available by request