Dorzolamide hydrochloride
Properties
- Molecular formula
- C10H17ClN2O4S3
- Molar mass
- 360.89 g/mol
- Exact mass
- 360.0039 Da
- Melting point
- 283–285 °C
- logP
- 1.03Crippen estimate
- Polar surface area
- 106.3 Ų
- H-bond donors / acceptors
- 2 / 6
- Rotatable bonds
- 3
- Stereocentres
- S, Sin SMILES atom order
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H373 May causes damage to organs through prolonged or repeated exposure92.1% of notifiers
Aggregated from 126 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P264, P270, P301+P317, P319, P330, P501
Identifiers
CAS number
130693-82-2SMILES
CCN[C@H]1C[C@H](C)S(=O)(=O)c2sc(S(N)(=O)=O)cc21.ClInChIKey
OSRUSFPMRGDLAG-QMGYSKNISA-NInChI
InChI=1S/C10H16N2O4S3.ClH/c1-3-12-8-4-6(2)18(13,14)10-7(8)5-9(17-10)19(11,15)16;/h5-6,8,12H,3-4H2,1-2H3,(H2,11,15,16);1H/t6-,8-;/m0./s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- 4H-Thieno[2,3-b]thiopyran-2-sulfonamide, 4-(ethylamino)-5,6-dihydro-6-methyl-, 7,7-dioxide, hydrochloride (1:1), (4S,6S)-
- 4H-Thieno[2,3-b]thiopyran-2-sulfonamide, 4-(ethylamino)-5,6-dihydro-6-methyl-, 7,7-dioxide, monohydrochloride, (4S-trans)-
- 4H-Thieno[2,3-b]thiopyran-2-sulfonamide, 4-(ethylamino)-5,6-dihydro-6-methyl-, 7,7-dioxide, monohydrochloride, (4S,6S)-
- L 671152
- MK 507
- Trusopt
- (S,S)-(-)-5,6-Dihydro-4-ethylamino-6-methyl-4H-thieno[2,3-b]thiopyran-2-sulfonamide-7,7-dioxide monohydrochloride
- Biosopt
- (4S,6S)-4-(Ethylamino)-5,6-dihydro-6-methyl-4H-thieno-[2,3-b]thiopyran-2-sulfonamide 7,7-dioxide hydrochloride
Work with Dorzolamide hydrochloride
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
N-[(4S,6S)-2-(Aminosulfonyl)-5,6-dihydro-6-methyl-7,7-dioxido-4H-thieno[2,3-b]thiopyran-4-yl]acetamide147200-03-152 % similar
Brinzolamide138890-62-748 % similar
(4S,6S)-5,6-Dihydro-4-hydroxy-6-methylthieno[2,3-b]thiopyran 7,7-dioxide147086-81-532 % similar
(4R,6S)-5,6-Dihydro-4-hydroxy-6-methylthieno[2,3-b]thiopyran-7,7-dioxide147128-77-632 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.