G765-0013 Screening compound: 3-(3,4-dihydro-2H-1-benzopyran-3-yl)-1-[(pyridin-2-yl)methyl]urea

G765-0013 Screening compound: 3-(3,4-dihydro-2H-1-benzopyran-3-yl)-1-[(pyridin-2-yl)methyl]urea
G765-0013 Screening compound: 3-(3,4-dihydro-2H-1-benzopyran-3-yl)-1-[(pyridin-2-yl)methyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound G765-0013
3-(3,4-dihydro-2H-1-benzopyran-3-yl)-1-[(pyridin-2-yl)methyl]urea

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

G765-0013

Molecular Formula

C16H17N3O2 (C16 H17 N3 O2)

Compound Name

3-(3,4-dihydro-2H-1-benzopyran-3-yl)-1-[(pyridin-2-yl)methyl]urea

IUPAC name

3-(34-dihydro-2H-1-benzopyran-3-yl)-1-[(pyridin-2-yl)methyl]urea

SMILES

O=C(NCc1ncccc1)NC(C1)COc2c1cccc2

InChI

InChI=1S/C16H17N3O2/c20-16(18-10-13-6-3-4-8-17-13)19-14-9-12-5-1-2-7-15(12)21-11-14/h1-8,14H,9-11H2,(H2,18,19,20)/t14-/m0/s1

InChI Key

FEQLTUHBKPJWLT-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD15034193

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

283.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.023

Distribution Coefficient, logD

2.023

Water Solubility, LogSw

-2.37

Polar Surface Area

52.632

Acid Dissociation Constant (pKa)

14.09

Base Dissociation Constant (pKb)

4.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

G765-0013 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Soluble Diversity Library (15920 compounds)

Targeted Diversity Library (40567 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Proteases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G765-0013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G765-0013?
Check Price and Availability of G765-0013, 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 G765-0013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G765-0013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G765-0013
  • 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 G765-0013 available by request