(1R)-10,10-Dimethyl-3λ[6]-thia-4-azatricyclo[5.2.1.0[1,5]]dec-4-ene-3,3-dione

C₁₀H₁₅NO₂SCAS 107869-45-4213.29 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₁₅NO₂S
Molar mass: 213.29 g/mol
Exact mass: 213.0823 Da
logP: 1.60Crippen estimate
Polar surface area: 46.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

107869-45-4

SMILES

CC1(C)[C@H]2CC[C@@]13CS(=O)(=O)N=C3C2

InChIKey

ZAHOEBNYVSWBBW-XVKPBYJWSA-N

InChI

InChI=1S/C10H15NO2S/c1-9(2)7-3-4-10(9)6-14(12,13)11-8(10)5-7/h7H,3-6H2,1-2H3/t7-,10-/m0/s1

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Names and synonyms

3 names

3H-3A,6-Methano-2,1-benzisothiazole, 4,5,6,7-tetrahydro-8,8-dimethyl-, 2,2-dioxide, (3ar,6S)-
3H-3a,6-Methano-2,1-benzisothiazole, 4,5,6,7-tetrahydro-8,8-dimethyl-, 2,2-dioxide, (3aR)-
(1R)-10,10-Dimethyl-3-thia-4-azatricyclo[5.2.1.0[1,5]]dec-4-ene-3,3-dione

Work with (1R)-10,10-Dimethyl-3λ[6]-thia-4-azatricyclo[5.2.1.0[1,5]]dec-4-ene-3,3-dione

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

(1S,2S)-2-Amino-1-[4-(methylthio)phenyl]-1,3-propanediol16854-32-3 N-Butylbenzenesulfonamide3622-84-2 4-tert-Butylbenzenesulfonamide6292-59-7 2-(4-Methyl-5-thiazolyl)ethyl butanoate94159-31-6

Elsewhere

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