C683-0002 Screening compound: 4-(ethylsulfanyl)-2-phenyl-5H-chromeno[2,3-d]pyrimidine

C683-0002 Screening compound: 4-(ethylsulfanyl)-2-phenyl-5H-chromeno[2,3-d]pyrimidine
C683-0002 Screening compound: 4-(ethylsulfanyl)-2-phenyl-5H-chromeno[2,3-d]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound C683-0002
4-(ethylsulfanyl)-2-phenyl-5H-chromeno[2,3-d]pyrimidine

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

C683-0002

Molecular Formula

C19H16N2OS (C19 H16 N2 OS)

Compound Name

4-(ethylsulfanyl)-2-phenyl-5H-chromeno[2,3-d]pyrimidine

IUPAC name

4-(ethylsulfanyl)-2-phenyl-5H-chromeno[23-d]pyrimidine

SMILES

CCSc1nc(-c2ccccc2)nc2c1Cc(cccc1)c1O2

InChI

InChI=1S/C19H16N2OS/c1-2-23-19-15-12-14-10-6-7-11-16(14)22-18(15)20-17(21-19)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3

InChI Key

RMJZPOBUNVDIET-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14782444

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.127

Distribution Coefficient, logD

6.124

Water Solubility, LogSw

-5.84

Polar Surface Area

26.402

Acid Dissociation Constant (pKa)

9.55

Base Dissociation Constant (pKb)

2.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

C683-0002 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C683-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C683-0002?
Check Price and Availability of C683-0002, 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 C683-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C683-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C683-0002
  • 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 C683-0002 available by request