N-[(3-methylphenyl)methyl]-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Chemical Structure Depiction of
N-[(3-methylphenyl)methyl]-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
N-[(3-methylphenyl)methyl]-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Compound characteristics
| Compound ID: | F510-0077 |
| Compound Name: | N-[(3-methylphenyl)methyl]-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide |
| Molecular Weight: | 423.53 |
| Molecular Formula: | C23 H25 N3 O3 S |
| Smiles: | Cc1cccc(CNC(CN2C(CSc3ccc(cc23)C(N2CCCC2)=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.6855 |
| logD: | 2.6855 |
| logSw: | -2.9207 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.105 |
| InChI Key: | QTHBBKHNYBAQRS-UHFFFAOYSA-N |