ethyl 4-(4-benzyl-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl)piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-benzyl-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl)piperazine-1-carboxylate
ethyl 4-(4-benzyl-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl)piperazine-1-carboxylate
Compound characteristics
Compound ID: | C699-0226 |
Compound Name: | ethyl 4-(4-benzyl-3,4-dihydro-2H-1,4-benzothiazine-6-carbonyl)piperazine-1-carboxylate |
Molecular Weight: | 425.55 |
Molecular Formula: | C23 H27 N3 O3 S |
Smiles: | CCOC(N1CCN(CC1)C(c1ccc2c(c1)N(CCS2)Cc1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.262 |
logD: | 3.262 |
logSw: | -3.4713 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 42.23 |
InChI Key: | FEVQNPJBVQBAPF-UHFFFAOYSA-N |