4-[2,5-dimethoxy-4-(1H-tetrazol-1-yl)benzene-1-sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine
Chemical Structure Depiction of
4-[2,5-dimethoxy-4-(1H-tetrazol-1-yl)benzene-1-sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine
4-[2,5-dimethoxy-4-(1H-tetrazol-1-yl)benzene-1-sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine
Compound characteristics
Compound ID: | 8018-2190 |
Compound Name: | 4-[2,5-dimethoxy-4-(1H-tetrazol-1-yl)benzene-1-sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine |
Molecular Weight: | 403.41 |
Molecular Formula: | C17 H17 N5 O5 S |
Smiles: | COc1cc(c(cc1n1cnnn1)OC)S(N1CCOc2ccccc12)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.0827 |
logD: | 2.0827 |
logSw: | -2.5612 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 94.067 |
InChI Key: | APFYLHXSULZRDX-UHFFFAOYSA-N |