N-[(3-methoxyphenyl)methyl]-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
N-[(3-methoxyphenyl)methyl]-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | F943-0136 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C21 H23 N3 O5 S2 |
| Smiles: | COc1cccc(CNS(c2ccc3c(c2)SC(N3CC(N2CCCC2)=O)=O)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.0539 |
| logD: | 3.0536 |
| logSw: | -3.6733 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.872 |
| InChI Key: | TYDVJAFVOQXKSQ-UHFFFAOYSA-N |