C908-0234 Screening compound: N-{[5-amino-1-(2,1,3-benzothiadiazole-4-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide

C908-0234 Screening compound: N-{[5-amino-1-(2,1,3-benzothiadiazole-4-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide
C908-0234 Screening compound: N-{[5-amino-1-(2,1,3-benzothiadiazole-4-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C908-0234
N-{[5-amino-1-(2,1,3-benzothiadiazole-4-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-2,1,3-benzothiadiazole-4-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

C908-0234

Molecular Formula

C15H11N9O4S4 (C15 H11 N9 O4 S4)

Compound Name

N-{[5-amino-1-(2,1,3-benzothiadiazole-4-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide

IUPAC name

N-{[5-amino-1-(213-benzothiadiazole-4-sulfonyl)-1H-124-triazol-3-yl]methyl}-213-benzothiadiazole-4-sulfonamide

SMILES

Nc1nc(CNS(c2cccc3nsnc23)(=O)=O)nn1S(c1cccc2nsnc12)(=O)=O

InChI

InChI=1S/C15H11N9O4S4/c16-15-18-12(7-17-31(25,26)10-5-1-3-8-13(10)22-29-20-8)19-24(15)32(27,28)11-6-2-4-9-14(11)23-30-21-9/h1-6,17H,7H2,(H2,16,18,19)

InChI Key

ALDBXGHCXQYHFJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14807658

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

509.57

Hydrogen Bond Acceptors Count

15.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

13

Partition Coefficient, logP

1.233

Distribution Coefficient, logD

0.495

Water Solubility, LogSw

-2.20

Polar Surface Area

155.779

Acid Dissociation Constant (pKa)

6.75

Base Dissociation Constant (pKb)

0.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

References: we are preparing a list of scientific research reports with C908-0234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C908-0234?
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What is the minimum amount of C908-0234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C908-0234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C908-0234
  • 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 C908-0234 available by request