N-[(5-bromo-2-methoxyphenyl)methyl]-4-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-4-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-4-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
Compound ID: | C796-0270 |
Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-4-[(4-methylphenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
Molecular Weight: | 497.45 |
Molecular Formula: | C25 H25 Br N2 O2 S |
Smiles: | Cc1ccc(CN2CCSc3ccc(cc23)C(NCc2cc(ccc2OC)[Br])=O)cc1 |
Stereo: | ACHIRAL |
logP: | 5.7098 |
logD: | 5.7098 |
logSw: | -5.3806 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 34.845 |
InChI Key: | HYVYODLVSGHFPZ-UHFFFAOYSA-N |