0934-1280 Screening compound: 4-[(3-mesityl-9H-[1,2,3,5]oxatriazolo[3,2-a][1,2,3]benzotriazol-9-yl)carbonyl]-N~1~,N~1~-dimethyl-1-benzenesulfonamide

0934-1280 Screening compound: 4-[(3-mesityl-9H-[1,2,3,5]oxatriazolo[3,2-a][1,2,3]benzotriazol-9-yl)carbonyl]-N~1~,N~1~-dimethyl-1-benzenesulfonamide
0934-1280 Screening compound: 4-[(3-mesityl-9H-[1,2,3,5]oxatriazolo[3,2-a][1,2,3]benzotriazol-9-yl)carbonyl]-N~1~,N~1~-dimethyl-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0934-1280
4-[(3-mesityl-9H-[1,2,3,5]oxatriazolo[3,2-a][1,2,3]benzotriazol-9-yl)carbonyl]-N~1~,N~1~-dimethyl-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

0934-1280

Molecular Formula

C25H25N5O4S (C25 H25 N5 O4 S)

Compound Name

4-[(3-mesityl-9H-[1,2,3,5]oxatriazolo[3,2-a][1,2,3]benzotriazol-9-yl)carbonyl]-N~1~,N~1~-dimethyl-1-benzenesulfonamide

IUPAC name

NN-dimethyl-4-[3-(246-trimethylphenyl)-5-oxa-2467-tetraazatricyclo[6.4.0.0^{26}]dodeca-1(12)3810-tetraene-7-carbonyl]benzene-1-sulfonamide

SMILES

Cc1cc(C)c(C2=NON3N2c(cccc2)c2N3C(c(cc2)ccc2S(N(C)C)(=O)=O)=O)c(C)c1

InChI

InChI=1S/C25H25N5O4S/c1-16-14-17(2)23(18(3)15-16)24-26-34-30-28(24)21-8-6-7-9-22(21)29(30)25(31)19-10-12-20(13-11-19)35(32,33)27(4)5/h6-15H,1-5H3

InChI Key

WTQVPIUVQUXXGX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00993502

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.57

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.197

Distribution Coefficient, logD

4.197

Water Solubility, LogSw

-4.44

Polar Surface Area

82.739

Acid Dissociation Constant (pKa)

27.63

Base Dissociation Constant (pKb)

-3.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

0934-1280 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 0934-1280 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 0934-1280 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0934-1280
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0934-1280
  • 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 0934-1280 available by request