3-{[4-(3-methylbutoxy)phenyl]methyl}-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-{[4-(3-methylbutoxy)phenyl]methyl}-1,3-benzothiazol-2(3H)-one
3-{[4-(3-methylbutoxy)phenyl]methyl}-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | 7074-0073 |
| Compound Name: | 3-{[4-(3-methylbutoxy)phenyl]methyl}-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 327.44 |
| Molecular Formula: | C19 H21 N O2 S |
| Smiles: | CC(C)CCOc1ccc(CN2C(=O)Sc3ccccc23)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3947 |
| logD: | 5.3947 |
| logSw: | -5.303 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 23.229 |
| InChI Key: | OOGPETFBROGQPB-UHFFFAOYSA-N |