D186-0030 Screening compound: 1-(1-butyl-1H-1,3-benzodiazol-2-yl)propan-1-ol

D186-0030 Screening compound: 1-(1-butyl-1H-1,3-benzodiazol-2-yl)propan-1-ol
D186-0030 Screening compound: 1-(1-butyl-1H-1,3-benzodiazol-2-yl)propan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D186-0030
1-(1-butyl-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

D186-0030

Molecular Formula

C14H20N2O (C14 H20 N2 O)

Compound Name

1-(1-butyl-1H-1,3-benzodiazol-2-yl)propan-1-ol

IUPAC name

1-(1-butyl-1H-13-benzodiazol-2-yl)propan-1-ol

SMILES

CCCCn1c(cccc2)c2nc1C(CC)O

InChI

InChI=1S/C14H20N2O/c1-3-5-10-16-12-9-7-6-8-11(12)15-14(16)13(17)4-2/h6-9,13,17H,3-5,10H2,1-2H3/t13-/m0/s1

InChI Key

FNKUYZWXISPLNF-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD08236344

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

232.33

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

3.427

Distribution Coefficient, logD

3.426

Water Solubility, LogSw

-3.20

Polar Surface Area

26.569

Acid Dissociation Constant (pKa)

14.91

Base Dissociation Constant (pKb)

4.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

D186-0030 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D186-0030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D186-0030?
Check Price and Availability of D186-0030, 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 D186-0030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D186-0030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D186-0030
  • 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 D186-0030 available by request