N-ethyl-N-(4-methoxyphenyl)-3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-ethyl-N-(4-methoxyphenyl)-3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-ethyl-N-(4-methoxyphenyl)-3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
Compound ID: | G008-1850 |
Compound Name: | N-ethyl-N-(4-methoxyphenyl)-3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
Molecular Weight: | 406.52 |
Molecular Formula: | C19 H22 N2 O4 S2 |
Smiles: | CCN(c1ccc(cc1)OC)S(c1ccc2c(c1)NC(C(C)CS2)=O)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.506 |
logD: | 3.5056 |
logSw: | -3.8457 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.541 |
InChI Key: | YWNGHIHYBJWQQP-CYBMUJFWSA-N |