6-(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-2,3,4,9-tetrahydro-1H-carbazole
Chemical Structure Depiction of
6-(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-2,3,4,9-tetrahydro-1H-carbazole
6-(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-2,3,4,9-tetrahydro-1H-carbazole
Compound characteristics
Compound ID: | K906-4613 |
Compound Name: | 6-(6-chloro-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-2,3,4,9-tetrahydro-1H-carbazole |
Molecular Weight: | 402.9 |
Molecular Formula: | C20 H19 Cl N2 O3 S |
Smiles: | C1CCc2c(C1)c1cc(ccc1[nH]2)S(N1CCOc2ccc(cc12)[Cl])(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.093 |
logD: | 4.093 |
logSw: | -4.438 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.113 |
InChI Key: | ONQJDYUZUTYPTB-UHFFFAOYSA-N |