G765-0286 Screening compound: 1-(3,4-dihydro-2H-1-benzopyran-3-yl)-3-[3-(propylsulfanyl)propyl]urea

G765-0286 Screening compound: 1-(3,4-dihydro-2H-1-benzopyran-3-yl)-3-[3-(propylsulfanyl)propyl]urea
G765-0286 Screening compound: 1-(3,4-dihydro-2H-1-benzopyran-3-yl)-3-[3-(propylsulfanyl)propyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound G765-0286
1-(3,4-dihydro-2H-1-benzopyran-3-yl)-3-[3-(propylsulfanyl)propyl]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

G765-0286

Molecular Formula

C16H24N2O2S (C16 H24 N2 O2 S)

Compound Name

1-(3,4-dihydro-2H-1-benzopyran-3-yl)-3-[3-(propylsulfanyl)propyl]urea

IUPAC name

1-(34-dihydro-2H-1-benzopyran-3-yl)-3-[3-(propylsulfanyl)propyl]urea

SMILES

CCCSCCCNC(NC(C1)COc2c1cccc2)=O

InChI

InChI=1S/C16H24N2O2S/c1-2-9-21-10-5-8-17-16(19)18-14-11-13-6-3-4-7-15(13)20-12-14/h3-4,6-7,14H,2,5,8-12H2,1H3,(H2,17,18,19)/t14-/m0/s1

InChI Key

CLLGXTPUOVQOIB-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD15034334

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.083

Distribution Coefficient, logD

3.083

Water Solubility, LogSw

-3.38

Polar Surface Area

43.202

Acid Dissociation Constant (pKa)

15.77

Base Dissociation Constant (pKb)

2.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

56.30

G765-0286 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G765-0286 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G765-0286?
Check Price and Availability of G765-0286, 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 G765-0286 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G765-0286
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G765-0286
  • 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 G765-0286 available by request