N-[3-(azepan-1-yl)propyl]-2-benzylidene-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-2-benzylidene-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N-[3-(azepan-1-yl)propyl]-2-benzylidene-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | K788-9516 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-2-benzylidene-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 435.59 |
| Molecular Formula: | C25 H29 N3 O2 S |
| Smiles: | C1CCCN(CC1)CCCNC(c1ccc2c(c1)NC(/C(=C/c1ccccc1)S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3793 |
| logD: | 1.8086 |
| logSw: | -4.106 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.413 |
| InChI Key: | XUXDJNNQXNDRAV-UHFFFAOYSA-N |