ethyl 4-[(4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)amino]piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[(4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)amino]piperidine-1-carboxylate
ethyl 4-[(4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)amino]piperidine-1-carboxylate
Compound characteristics
Compound ID: | G008-2696 |
Compound Name: | ethyl 4-[(4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)amino]piperidine-1-carboxylate |
Molecular Weight: | 413.51 |
Molecular Formula: | C17 H23 N3 O5 S2 |
Smiles: | CCOC(N1CCC(CC1)NS(c1ccc2c(c1)NC(CCS2)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.8387 |
logD: | 1.8385 |
logSw: | -2.6964 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 89.867 |
InChI Key: | VGOXIXYEBOFNOI-UHFFFAOYSA-N |