2-(azepane-1-carbonyl)-4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one
2-(azepane-1-carbonyl)-4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | L592-2027 |
| Compound Name: | 2-(azepane-1-carbonyl)-4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C25 H27 N3 O3 S |
| Smiles: | C1CCCN(CC1)C(C1C(N(CC(N2CCc3ccccc23)=O)c2ccccc2S1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3615 |
| logD: | 3.3615 |
| logSw: | -3.5351 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.743 |
| InChI Key: | PTAMOFRQPAGDTF-QHCPKHFHSA-N |