Y080-1362 Screening compound: 1-(4-methylphenoxy)-3-{2-[(4-methylphenoxy)methyl]-1H-1,3-benzodiazol-1-yl}propan-2-ol

Y080-1362 Screening compound: 1-(4-methylphenoxy)-3-{2-[(4-methylphenoxy)methyl]-1H-1,3-benzodiazol-1-yl}propan-2-ol
Y080-1362 Screening compound: 1-(4-methylphenoxy)-3-{2-[(4-methylphenoxy)methyl]-1H-1,3-benzodiazol-1-yl}propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-1362
1-(4-methylphenoxy)-3-{2-[(4-methylphenoxy)methyl]-1H-1,3-benzodiazol-1-yl}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

Y080-1362

Molecular Formula

C25H26N2O3 (C25 H26 N2 O3)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)ccc1OCC(Cn1c(cccc2)c2nc1COc1ccc(C)cc1)O

InChI

InChI=1S/C25H26N2O3/c1-18-7-11-21(12-8-18)29-16-20(28)15-27-24-6-4-3-5-23(24)26-25(27)17-30-22-13-9-19(2)10-14-22/h3-14,20,28H,15-17H2,1-2H3/t20-/m0/s1

InChI Key

HAHWHNKTXTUHMM-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD02582716

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.49

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

5.580

Distribution Coefficient, logD

5.580

Water Solubility, LogSw

-5.52

Polar Surface Area

42.489

Acid Dissociation Constant (pKa)

16.48

Base Dissociation Constant (pKb)

1.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

24.00

Y080-1362 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with Y080-1362 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-1362?
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What is the minimum amount of Y080-1362 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-1362
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-1362
  • 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 Y080-1362 available by request