4-[(6,8-dimethyl-2-oxo-2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazin-1-yl)methyl]-N-[2-(4-ethylpiperazin-1-yl)ethyl]benzamide
Chemical Structure Depiction of
4-[(6,8-dimethyl-2-oxo-2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazin-1-yl)methyl]-N-[2-(4-ethylpiperazin-1-yl)ethyl]benzamide
4-[(6,8-dimethyl-2-oxo-2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazin-1-yl)methyl]-N-[2-(4-ethylpiperazin-1-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | E772-0472 |
| Compound Name: | 4-[(6,8-dimethyl-2-oxo-2,3-dihydro-1H-pyrido[2,3-b][1,4]thiazin-1-yl)methyl]-N-[2-(4-ethylpiperazin-1-yl)ethyl]benzamide |
| Molecular Weight: | 467.63 |
| Molecular Formula: | C25 H33 N5 O2 S |
| Smiles: | CCN1CCN(CCNC(c2ccc(CN3C(CSc4c3c(C)cc(C)n4)=O)cc2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.3999 |
| logD: | 1.6073 |
| logSw: | -2.6424 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.977 |
| InChI Key: | XAEHCDHTUUFQFI-UHFFFAOYSA-N |