3-[(7-{[(furan-2-yl)methyl]sulfanyl}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]propan-1-ol
Chemical Structure Depiction of
3-[(7-{[(furan-2-yl)methyl]sulfanyl}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]propan-1-ol
3-[(7-{[(furan-2-yl)methyl]sulfanyl}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]propan-1-ol
Compound characteristics
| Compound ID: | K784-6230 |
| Compound Name: | 3-[(7-{[(furan-2-yl)methyl]sulfanyl}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]propan-1-ol |
| Molecular Weight: | 350.35 |
| Molecular Formula: | C14 H14 N4 O5 S |
| Smiles: | C(CNc1cc(c2c(c1[N+]([O-])=O)non2)SCc1ccco1)CO |
| Stereo: | ACHIRAL |
| logP: | 2.7776 |
| logD: | 2.7776 |
| logSw: | -3.1237 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.661 |
| InChI Key: | HLYQFJBEFRRTJU-UHFFFAOYSA-N |