Y080-1201 Screening compound: 3-{1-[(2,4-dichlorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}propan-1-ol

Y080-1201 Screening compound: 3-{1-[(2,4-dichlorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}propan-1-ol
Y080-1201 Screening compound: 3-{1-[(2,4-dichlorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}propan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-1201
3-{1-[(2,4-dichlorophenyl)methyl]-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

Y080-1201

Molecular Formula

C17H16Cl2N2O (C17 H16 Cl2 N2 O)

Compound Name

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

IUPAC name

3-{1-[(24-dichlorophenyl)methyl]-1H-13-benzodiazol-2-yl}propan-1-ol

SMILES

OCCCc1nc(cccc2)c2n1Cc(ccc(Cl)c1)c1Cl

InChI

InChI=1S/C17H16Cl2N2O/c18-13-8-7-12(14(19)10-13)11-21-16-5-2-1-4-15(16)20-17(21)6-3-9-22/h1-2,4-5,7-8,10,22H,3,6,9,11H2

InChI Key

LICMESCKGWLXFU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03130206

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.23

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.367

Distribution Coefficient, logD

4.364

Water Solubility, LogSw

-4.33

Polar Surface Area

27.799

Acid Dissociation Constant (pKa)

15.93

Base Dissociation Constant (pKb)

5.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.53

References: we are preparing a list of scientific research reports with Y080-1201 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-1201?
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What is the minimum amount of Y080-1201 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-1201
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-1201
  • 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 Y080-1201 available by request