E626-0730 Screening compound: methyl 2-{1-[6-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidine-3-amido}benzoate

E626-0730 Screening compound: methyl 2-{1-[6-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidine-3-amido}benzoate
E626-0730 Screening compound: methyl 2-{1-[6-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidine-3-amido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound E626-0730
methyl 2-{1-[6-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidine-3-amido}benzoate

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

E626-0730

Molecular Formula

C25H25N5O4S (C25 H25 N5 O4 S)

Compound Name

methyl 2-{1-[6-(4-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidine-3-amido}benzoate

IUPAC name

methyl 2-{1-[6-(4-methoxyphenyl)imidazo[21-b][134]thiadiazol-2-yl]piperidine-3-amido}benzoate

SMILES

COC(c(cccc1)c1NC(C(CCC1)CN1c(s1)nn2c1nc(-c(cc1)ccc1OC)c2)=O)=O

InChI

InChI=1S/C25H25N5O4S/c1-33-18-11-9-16(10-12-18)21-15-30-24(27-21)35-25(28-30)29-13-5-6-17(14-29)22(31)26-20-8-4-3-7-19(20)23(32)34-2/h3-4,7-12,15,17H,5-6,13-14H2,1-2H3,(H,26,31)/t17-/m0/s1

InChI Key

YLCQKZVORWTCFH-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD14905019

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.296

Distribution Coefficient, logD

4.216

Water Solubility, LogSw

-4.11

Polar Surface Area

75.570

Acid Dissociation Constant (pKa)

8.10

Base Dissociation Constant (pKb)

3.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.00

References: we are preparing a list of scientific research reports with E626-0730 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E626-0730?
Check Price and Availability of E626-0730, 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 E626-0730 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E626-0730
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E626-0730
  • 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 E626-0730 available by request