4-[(4-methylphenyl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(4-methylphenyl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-[(4-methylphenyl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C699-0437 |
| Compound Name: | 4-[(4-methylphenyl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 438.63 |
| Molecular Formula: | C25 H34 N4 O S |
| Smiles: | Cc1ccc(CN2CCSc3ccc(cc23)C(NCCCN2CCN(C)CC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9254 |
| logD: | 1.775 |
| logSw: | -3.3946 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.515 |
| InChI Key: | QFGJRYXCULDYHZ-UHFFFAOYSA-N |