F449-4620 Screening compound: ethyl 1-(2-{[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}acetyl)piperidine-3-carboxylate

F449-4620 Screening compound: ethyl 1-(2-{[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}acetyl)piperidine-3-carboxylate
F449-4620 Screening compound: ethyl 1-(2-{[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}acetyl)piperidine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F449-4620
ethyl 1-(2-{[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}acetyl)piperidine-3-carboxylate

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

F449-4620

Molecular Formula

C25H34N6O3S (C25 H34 N6 O3 S)

Compound Name

ethyl 1-(2-{[5-(tert-butylamino)-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-yl](methyl)amino}acetyl)piperidine-3-carboxylate

IUPAC name

ethyl 1-(2-{[5-(tert-butylamino)-6-phenylimidazo[21-b][134]thiadiazol-2-yl](methyl)amino}acetyl)piperidine-3-carboxylate

SMILES

CCOC(C(CCC1)CN1C(CN(C)c(s1)nn2c1nc(-c1ccccc1)c2NC(C)(C)C)=O)=O

InChI

InChI=1S/C25H34N6O3S/c1-6-34-22(33)18-13-10-14-30(15-18)19(32)16-29(5)24-28-31-21(27-25(2,3)4)20(26-23(31)35-24)17-11-8-7-9-12-17/h7-9,11-12,18,27H,6,10,13-16H2,1-5H3/t18-/m0/s1

InChI Key

PHABLXIAGKSLPN-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27130037

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.65

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.842

Distribution Coefficient, logD

3.842

Water Solubility, LogSw

-3.77

Polar Surface Area

70.362

Acid Dissociation Constant (pKa)

17.24

Base Dissociation Constant (pKb)

3.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.00

References: we are preparing a list of scientific research reports with F449-4620 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F449-4620?
Check Price and Availability of F449-4620, 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 F449-4620 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F449-4620
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F449-4620
  • 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 F449-4620 available by request