N-Deethyldorzolamide hydrochloride

Base Information

• Chemical Name: N-Deethyldorzolamide hydrochloride
• CAS No.: 164455-27-0
• Molecular Formula: C8H12 N2 O4 S3 . Cl H
• Molecular Weight: 332.86
• Hs Code.: 2935909550
• UNII: P7DT2GS6VD
• DSSTox Substance ID: DTXSID80167761
• Mol file: 164455-27-0.mol

Synonyms:N-Deethyldorzolamide hydrochloride;164455-27-0;UNII-P7DT2GS6VD;P7DT2GS6VD;L 706803;Dorzolamide Impurity D HCl (N-Desethyl Dorzolamide HCl);4H-Thieno(2,3-b)thiopyran-2-sulfonamide, 5,6-dihydro-4-amino-6-methyl-, 7,7-dioxide, monohydrochloride, (4S-trans)-;(4S,6S)-4-amino-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide;hydrochloride;C8H12N2O4S3.ClH;SCHEMBL16654313;DTXSID80167761;C8-H12-N2-O4-S3.Cl-H;LS-152561;L-706803;Q27286321;4H-THIENO(2,3-B)THIOPYRAN-2-SULFONAMIDE, 4-AMINO-5,6-DIHYDRO-6-METHYL-, 7,7-DIOXIDE, MONOHYDROCHLORIDE, (4S,6S)-;4H-THIENO(2,3-B)THIOPYRAN-2-SULFONAMIDE, 4-AMINO-5,6-DIHYDRO-6-METHYL-, 7,7-DIOXIDE, MONOHYDROCHLORIDE, (4S-TRANS)-

Chemical Property of N-Deethyldorzolamide hydrochloride

Chemical Property:

• Vapor Pressure: 1.22E-13mmHg at 25°C
• Boiling Point: 584.3°C at 760 mmHg
• Flash Point: 307.2°C
• PSA: 165.32000
• LogP: 4.32540
• Storage Temp.: Hygroscopic, -20°C Freezer, Under inert atmosphere
• Solubility.: Methanol (Slightly)
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 1
• Exact Mass: 331.9725981
• Heavy Atom Count: 18
• Complexity: 504

Purity/Quality:

99% ^*data from raw suppliers

N-DeethylDorzolamideHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC(C2=C(S1(=O)=O)SC(=C2)S(=O)(=O)N)N.Cl
• Isomeric SMILES: C[C@H]1C[C@@H](C2=C(S1(=O)=O)SC(=C2)S(=O)(=O)N)N.Cl
• Uses: N-Deethyl Dorzolamide Hydrochloride is a metabolite of Dorzolamide (D535100), a carbonic anhydrase inhibitor. Antiglaucoma agent.