3-[(4-butoxy-3-methoxyphenyl)methyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-[(4-butoxy-3-methoxyphenyl)methyl]-1,3-benzothiazol-2(3H)-one
3-[(4-butoxy-3-methoxyphenyl)methyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | 7074-0064 |
| Compound Name: | 3-[(4-butoxy-3-methoxyphenyl)methyl]-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 343.44 |
| Molecular Formula: | C19 H21 N O3 S |
| Smiles: | CCCCOc1ccc(CN2C(=O)Sc3ccccc23)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.7604 |
| logD: | 4.7604 |
| logSw: | -4.4828 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 30.9461 |
| InChI Key: | GEEHLPRUBVMJGB-UHFFFAOYSA-N |