N-{3-[bis(2-methylpropyl)amino]propyl}-2-[(4-methoxyphenyl)methylidene]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-{3-[bis(2-methylpropyl)amino]propyl}-2-[(4-methoxyphenyl)methylidene]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N-{3-[bis(2-methylpropyl)amino]propyl}-2-[(4-methoxyphenyl)methylidene]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
Compound ID: | C310-1133 |
Compound Name: | N-{3-[bis(2-methylpropyl)amino]propyl}-2-[(4-methoxyphenyl)methylidene]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
Molecular Weight: | 509.71 |
Molecular Formula: | C29 H39 N3 O3 S |
Smiles: | CC(C)CN(CCCNC(c1ccc2c(c1)N(C)C(/C(=C/c1ccc(cc1)OC)S2)=O)=O)CC(C)C |
Stereo: | ACHIRAL |
logP: | 5.316 |
logD: | 2.5206 |
logSw: | -5.1962 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.139 |
InChI Key: | XYMNTQHTHOOODE-UHFFFAOYSA-N |