P585-2635 Screening compound: N~1~-(2-ethylphenyl)-2-[4-(3-fluorophenyl)-1,1-dioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetamide

P585-2635 Screening compound: N~1~-(2-ethylphenyl)-2-[4-(3-fluorophenyl)-1,1-dioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetamide
P585-2635 Screening compound: N~1~-(2-ethylphenyl)-2-[4-(3-fluorophenyl)-1,1-dioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P585-2635
N~1~-(2-ethylphenyl)-2-[4-(3-fluorophenyl)-1,1-dioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetamide

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

P585-2635

Molecular Formula

C22H21FN4O3S (C22 H21 FN4 O3 S)

Compound Name

N~1~-(2-ethylphenyl)-2-[4-(3-fluorophenyl)-1,1-dioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetamide

IUPAC name

N-(2-ethylphenyl)-2-[4-(3-fluorophenyl)-11-dioxo-2H3H4H-1lambda6-pyrido[23-e][124]thiadiazin-2-yl]acetamide

SMILES

CCc(cccc1)c1NC(CN(CN(c1cc(F)ccc1)c1c2cccn1)S2(=O)=O)=O

InChI

InChI=1S/C22H21FN4O3S/c1-2-16-7-3-4-10-19(16)25-21(28)14-26-15-27(18-9-5-8-17(23)13-18)22-20(31(26,29)30)11-6-12-24-22/h3-13H,2,14-15H2,1H3,(H,25,28)

InChI Key

GBXOEUSFAYMEDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD22596914

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.902

Distribution Coefficient, logD

3.902

Water Solubility, LogSw

-3.79

Polar Surface Area

67.267

Acid Dissociation Constant (pKa)

12.03

Base Dissociation Constant (pKb)

0.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with P585-2635 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P585-2635?
Check Price and Availability of P585-2635, 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 P585-2635 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P585-2635
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P585-2635
  • 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 P585-2635 available by request