CM4298-0574 Screening compound: 3-[1-methyl-3-(3-thienyl)-1H-1,2,4-triazol-5-yl]-N~1~-(tetrahydro-2-furanylmethyl)-1-azetanecarboxamide

CM4298-0574 Screening compound: 3-[1-methyl-3-(3-thienyl)-1H-1,2,4-triazol-5-yl]-N~1~-(tetrahydro-2-furanylmethyl)-1-azetanecarboxamide
CM4298-0574 Screening compound: 3-[1-methyl-3-(3-thienyl)-1H-1,2,4-triazol-5-yl]-N~1~-(tetrahydro-2-furanylmethyl)-1-azetanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound CM4298-0574
3-[1-methyl-3-(3-thienyl)-1H-1,2,4-triazol-5-yl]-N~1~-(tetrahydro-2-furanylmethyl)-1-azetanecarboxamide

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

CM4298-0574

Molecular Formula

C16H21N5O2S (C16 H21 N5 O2 S)

Compound Name

3-[1-methyl-3-(3-thienyl)-1H-1,2,4-triazol-5-yl]-N~1~-(tetrahydro-2-furanylmethyl)-1-azetanecarboxamide

IUPAC name

n/a

SMILES

Cn1nc(-c2cscc2)nc1C(C1)CN1C(NCC1OCCC1)=O

InChI

InChI=1S/C16H21N5O2S/c1-20-15(18-14(19-20)11-4-6-24-10-11)12-8-21(9-12)16(22)17-7-13-3-2-5-23-13/h4,6,10,12-13H,2-3,5,7-9H2,1H3,(H,17,22)/t13-/m1/s1

InChI Key

FRTUPNCTCINOEF-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD30458836

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.147

Distribution Coefficient, logD

1.146

Water Solubility, LogSw

-2.14

Polar Surface Area

60.701

Acid Dissociation Constant (pKa)

15.16

Base Dissociation Constant (pKb)

4.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

56.30

References: we are preparing a list of scientific research reports with CM4298-0574 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM4298-0574?
Check Price and Availability of CM4298-0574, 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 CM4298-0574 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM4298-0574
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM4298-0574
  • 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 CM4298-0574 available by request