D010-0110 Screening compound: 4-{[(1-propyl-1H-1,3-benzodiazol-2-yl)amino]methyl}phenol

D010-0110 Screening compound: 4-{[(1-propyl-1H-1,3-benzodiazol-2-yl)amino]methyl}phenol
D010-0110 Screening compound: 4-{[(1-propyl-1H-1,3-benzodiazol-2-yl)amino]methyl}phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound D010-0110
4-{[(1-propyl-1H-1,3-benzodiazol-2-yl)amino]methyl}phenol

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

D010-0110

Molecular Formula

C17H19N3O (C17 H19 N3 O)

Compound Name

4-{[(1-propyl-1H-1,3-benzodiazol-2-yl)amino]methyl}phenol

IUPAC name

4-{[(1-propyl-1H-13-benzodiazol-2-yl)amino]methyl}phenol

SMILES

CCCn1c(NCc(cc2)ccc2O)nc2c1cccc2

InChI

InChI=1S/C17H19N3O/c1-2-11-20-16-6-4-3-5-15(16)19-17(20)18-12-13-7-9-14(21)10-8-13/h3-10,21H,2,11-12H2,1H3,(H,18,19)

InChI Key

AMVXQKGIDQPCED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09270979

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

281.36

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.512

Distribution Coefficient, logD

3.471

Water Solubility, LogSw

-3.43

Polar Surface Area

40.176

Acid Dissociation Constant (pKa)

9.67

Base Dissociation Constant (pKb)

6.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

D010-0110 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D010-0110 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D010-0110?
Check Price and Availability of D010-0110, 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 D010-0110 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D010-0110
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D010-0110
  • 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 D010-0110 available by request