6-[(1,3-benzoxazol-2-yl)sulfanyl]-4-nitro-2,1,3-benzothiadiazole
Chemical Structure Depiction of
6-[(1,3-benzoxazol-2-yl)sulfanyl]-4-nitro-2,1,3-benzothiadiazole
6-[(1,3-benzoxazol-2-yl)sulfanyl]-4-nitro-2,1,3-benzothiadiazole
Compound characteristics
Compound ID: | 8016-4793 |
Compound Name: | 6-[(1,3-benzoxazol-2-yl)sulfanyl]-4-nitro-2,1,3-benzothiadiazole |
Molecular Weight: | 330.34 |
Molecular Formula: | C13 H6 N4 O3 S2 |
Smiles: | c1ccc2c(c1)nc(o2)Sc1cc(c2c(c1)nsn2)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 4.4534 |
logD: | 4.4534 |
logSw: | -4.6572 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 70.663 |
InChI Key: | BGVJMUDCJOGPRM-UHFFFAOYSA-N |