4-benzyl-N-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-benzyl-N-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-benzyl-N-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
Compound ID: | C699-0040 |
Compound Name: | 4-benzyl-N-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
Molecular Weight: | 422.98 |
Molecular Formula: | C24 H23 Cl N2 O S |
Smiles: | C(CNC(c1ccc2c(c1)N(CCS2)Cc1ccccc1)=O)c1ccc(cc1)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.9214 |
logD: | 4.9214 |
logSw: | -5.206 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 27.056 |
InChI Key: | YMHVYIFOOXBFJB-UHFFFAOYSA-N |