4476-4135 Screening compound: 5-(1-ethyl-1H-1,2,3,4-tetraazol-5-yl)-N~1~-(4-iodophenyl)-2-methoxy-1-benzenesulfonamide

4476-4135 Screening compound: 5-(1-ethyl-1H-1,2,3,4-tetraazol-5-yl)-N~1~-(4-iodophenyl)-2-methoxy-1-benzenesulfonamide
4476-4135 Screening compound: 5-(1-ethyl-1H-1,2,3,4-tetraazol-5-yl)-N~1~-(4-iodophenyl)-2-methoxy-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4476-4135
5-(1-ethyl-1H-1,2,3,4-tetraazol-5-yl)-N~1~-(4-iodophenyl)-2-methoxy-1-benzenesulfonamide

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

4476-4135

Molecular Formula

C16H16IN5O3S (C16 H16 IN5 O3 S)

Compound Name

5-(1-ethyl-1H-1,2,3,4-tetraazol-5-yl)-N~1~-(4-iodophenyl)-2-methoxy-1-benzenesulfonamide

IUPAC name

5-(1-ethyl-1H-1234-tetrazol-5-yl)-N-(4-iodophenyl)-2-methoxybenzene-1-sulfonamide

SMILES

CCn1nnnc1-c(cc1)cc(S(Nc(cc2)ccc2I)(=O)=O)c1OC

InChI

InChI=1S/C16H16IN5O3S/c1-3-22-16(18-20-21-22)11-4-9-14(25-2)15(10-11)26(23,24)19-13-7-5-12(17)6-8-13/h4-10,19H,3H2,1-2H3

InChI Key

ADRNPVHVFNQTMV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01946499

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.31

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.684

Distribution Coefficient, logD

3.226

Water Solubility, LogSw

-4.00

Polar Surface Area

87.447

Acid Dissociation Constant (pKa)

7.13

Base Dissociation Constant (pKb)

-0.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.75

References: we are preparing a list of scientific research reports with 4476-4135 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4476-4135?
Check Price and Availability of 4476-4135, 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 4476-4135 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4476-4135
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4476-4135
  • 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 4476-4135 available by request