PX5
4-(1,3-benzothiazol-2-yl)-4-hydroxycyclohexa-2,5-dien-1-one
Find entries where: PX5
as a non-polymer is covalently linked to polymer or other heterogen groups 1 entries
Chemical Component Summary | |
|---|---|
| Name | 4-(1,3-benzothiazol-2-yl)-4-hydroxycyclohexa-2,5-dien-1-one |
| Synonyms | 4-(benzothiazol-2-yl)-4-hydroxycyclohexa-2,5-dienone |
| Identifiers | 4-(1,3-benzothiazol-2-yl)-4-hydroxy-cyclohexa-2,5-dien-1-one |
| Formula | C13 H9 N O2 S |
| Molecular Weight | 243.281 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1ccc2c(c1)nc(s2)C3(C=CC(=O)C=C3)O |
| InChI | InChI=1S/C13H9NO2S/c15-9-5-7-13(16,8-6-9)12-14-10-3-1-2-4-11(10)17-12/h1-8,16H |
| InChIKey | SDYBYKXWYDVVKP-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 26 |
| Chiral Atom Count | 0 |
| Bond Count | 28 |
| Aromatic Bond Count | 10 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 482697 |
| ChEMBL | CHEMBL151831 |
