ethyl 1-[4-(cyclopropanecarbonyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[4-(cyclopropanecarbonyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl]piperidine-4-carboxylate
ethyl 1-[4-(cyclopropanecarbonyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl]piperidine-4-carboxylate
Compound characteristics
Compound ID: | F053-2576 |
Compound Name: | ethyl 1-[4-(cyclopropanecarbonyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl]piperidine-4-carboxylate |
Molecular Weight: | 438.56 |
Molecular Formula: | C20 H26 N2 O5 S2 |
Smiles: | CCOC(C1CCN(CC1)S(c1ccc2c(c1)N(CCS2)C(C1CC1)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.8945 |
logD: | 2.8945 |
logSw: | -3.3736 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 68.539 |
InChI Key: | BETCVKYDRAEHKR-UHFFFAOYSA-N |