8017-4462 Screening compound: N~1~-(tert-butyl)-2-[5-(2-thienyl)-2H-1,2,3,4-tetraazol-2-yl]acetamide

8017-4462 Screening compound: N~1~-(tert-butyl)-2-[5-(2-thienyl)-2H-1,2,3,4-tetraazol-2-yl]acetamide
8017-4462 Screening compound: N~1~-(tert-butyl)-2-[5-(2-thienyl)-2H-1,2,3,4-tetraazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-4462
N~1~-(tert-butyl)-2-[5-(2-thienyl)-2H-1,2,3,4-tetraazol-2-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

8017-4462

Molecular Formula

C11H15N5OS (C11 H15 N5 OS)

Compound Name

N~1~-(tert-butyl)-2-[5-(2-thienyl)-2H-1,2,3,4-tetraazol-2-yl]acetamide

IUPAC name

N-tert-butyl-2-[5-(thiophen-2-yl)-2H-1234-tetrazol-2-yl]acetamide

SMILES

CC(C)(C)NC(Cn1nnc(-c2cccs2)n1)=O

InChI

InChI=1S/C11H15N5OS/c1-11(2,3)12-9(17)7-16-14-10(13-15-16)8-5-4-6-18-8/h4-6H,7H2,1-3H3,(H,12,17)

InChI Key

FKONJWMIXSJVPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06002721

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

265.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.930

Distribution Coefficient, logD

1.930

Water Solubility, LogSw

-2.54

Polar Surface Area

62.927

Acid Dissociation Constant (pKa)

15.63

Base Dissociation Constant (pKb)

4.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.46

References: we are preparing a list of scientific research reports with 8017-4462 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-4462?
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What is the minimum amount of 8017-4462 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-4462
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-4462
  • 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 8017-4462 available by request