4-[(4-fluorophenyl)methyl]-1,3-dioxo-N-[2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(4-fluorophenyl)methyl]-1,3-dioxo-N-[2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carboxamide
4-[(4-fluorophenyl)methyl]-1,3-dioxo-N-[2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C531-0161 |
| Compound Name: | 4-[(4-fluorophenyl)methyl]-1,3-dioxo-N-[2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 429.51 |
| Molecular Formula: | C22 H24 F N3 O3 S |
| Smiles: | C1CCN(C1)CCNC(c1ccc2c(c1)N(Cc1ccc(cc1)F)C(CS2=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7674 |
| logD: | 0.3593 |
| logSw: | -2.6181 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.379 |
| InChI Key: | LZBZGWULQNWZLQ-UHFFFAOYSA-N |