7790-2671 Screening compound: 4-methyl-N-{2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl}benzene-1-sulfonamide

7790-2671 Screening compound: 4-methyl-N-{2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl}benzene-1-sulfonamide
7790-2671 Screening compound: 4-methyl-N-{2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl}benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7790-2671
4-methyl-N-{2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl}benzene-1-sulfonamide

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

7790-2671

Molecular Formula

C16H17N5O2S2 (C16 H17 N5 O2 S2)

Compound Name

4-methyl-N-{2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl}benzene-1-sulfonamide

IUPAC name

4-methyl-N-{2-[(1-phenyl-1H-1234-tetrazol-5-yl)sulfanyl]ethyl}benzene-1-sulfonamide

SMILES

Cc(cc1)ccc1S(NCCSc1nnnn1-c1ccccc1)(=O)=O

InChI

InChI=1S/C16H17N5O2S2/c1-13-7-9-15(10-8-13)25(22,23)17-11-12-24-16-18-19-20-21(16)14-5-3-2-4-6-14/h2-10,17H,11-12H2,1H3

InChI Key

RJJOCMGGYOVTAP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02582987

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.069

Distribution Coefficient, logD

3.069

Water Solubility, LogSw

-3.41

Polar Surface Area

81.760

Acid Dissociation Constant (pKa)

11.33

Base Dissociation Constant (pKb)

-1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

7790-2671 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 7790-2671 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7790-2671?
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What is the minimum amount of 7790-2671 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7790-2671
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7790-2671
  • 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 7790-2671 available by request