D510-0639 Screening compound: 1-[2-(methoxymethyl)-1H-1,3-benzodiazol-1-yl]-3-[4-(propan-2-yl)phenoxy]propan-2-ol

D510-0639 Screening compound: 1-[2-(methoxymethyl)-1H-1,3-benzodiazol-1-yl]-3-[4-(propan-2-yl)phenoxy]propan-2-ol
D510-0639 Screening compound: 1-[2-(methoxymethyl)-1H-1,3-benzodiazol-1-yl]-3-[4-(propan-2-yl)phenoxy]propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D510-0639
1-[2-(methoxymethyl)-1H-1,3-benzodiazol-1-yl]-3-[4-(propan-2-yl)phenoxy]propan-2-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

D510-0639

Molecular Formula

C21H26N2O3 (C21 H26 N2 O3)

Compound Name

1-[2-(methoxymethyl)-1H-1,3-benzodiazol-1-yl]-3-[4-(propan-2-yl)phenoxy]propan-2-ol

IUPAC name

1-[2-(methoxymethyl)-1H-13-benzodiazol-1-yl]-3-[4-(propan-2-yl)phenoxy]propan-2-ol

SMILES

CC(C)c(cc1)ccc1OCC(Cn1c(cccc2)c2nc1COC)O

InChI

InChI=1S/C21H26N2O3/c1-15(2)16-8-10-18(11-9-16)26-13-17(24)12-23-20-7-5-4-6-19(20)22-21(23)14-25-3/h4-11,15,17,24H,12-14H2,1-3H3/t17-/m0/s1

InChI Key

RUUWBMNGAKAQGO-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD12548329

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.424

Distribution Coefficient, logD

4.424

Water Solubility, LogSw

-4.29

Polar Surface Area

43.686

Acid Dissociation Constant (pKa)

16.48

Base Dissociation Constant (pKb)

3.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

D510-0639 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D510-0639 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D510-0639?
Check Price and Availability of D510-0639, 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 D510-0639 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D510-0639
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D510-0639
  • 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 D510-0639 available by request