N-{3-[bis(2-methylpropyl)amino]propyl}-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetamide
Chemical Structure Depiction of
N-{3-[bis(2-methylpropyl)amino]propyl}-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetamide
N-{3-[bis(2-methylpropyl)amino]propyl}-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetamide
Compound characteristics
| Compound ID: | C306-0546 |
| Compound Name: | N-{3-[bis(2-methylpropyl)amino]propyl}-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetamide |
| Molecular Weight: | 389.56 |
| Molecular Formula: | C21 H31 N3 O2 S |
| Smiles: | CC(C)CN(CCCNC(/C=C1/C(Nc2ccccc2S1)=O)=O)CC(C)C |
| Stereo: | ACHIRAL |
| logP: | 3.5758 |
| logD: | 0.7804 |
| logSw: | -3.7738 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.391 |
| InChI Key: | DXJSWWADGDARMD-UHFFFAOYSA-N |