3-amino-2-methyl-6-phenoxy-1-benzothiophen-1-ium-1-olate
Chemical Structure Depiction of
3-amino-2-methyl-6-phenoxy-1-benzothiophen-1-ium-1-olate
3-amino-2-methyl-6-phenoxy-1-benzothiophen-1-ium-1-olate
Compound characteristics
| Compound ID: | 8018-4216 |
| Compound Name: | 3-amino-2-methyl-6-phenoxy-1-benzothiophen-1-ium-1-olate |
| Molecular Weight: | 271.34 |
| Molecular Formula: | C15 H13 N O2 S |
| Smiles: | CC1=C(c2ccc(cc2[S+]1[O-])Oc1ccccc1)N |
| Stereo: | ACHIRAL |
| logP: | 3.4729 |
| logD: | 3.4729 |
| logSw: | -3.8873 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.462 |
| InChI Key: | FQTCLZKPEGAMGO-UHFFFAOYSA-N |