ethyl [10-(N,N-diethyl-beta-alanyl)-5-oxo-5,10-dihydro-5lambda~4~-phenothiazin-2-yl]carbamate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl [10-(N,N-diethyl-beta-alanyl)-5-oxo-5,10-dihydro-5lambda~4~-phenothiazin-2-yl]carbamate--hydrogen chloride (1/1)
ethyl [10-(N,N-diethyl-beta-alanyl)-5-oxo-5,10-dihydro-5lambda~4~-phenothiazin-2-yl]carbamate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 6204-0001 |
| Compound Name: | ethyl [10-(N,N-diethyl-beta-alanyl)-5-oxo-5,10-dihydro-5lambda~4~-phenothiazin-2-yl]carbamate--hydrogen chloride (1/1) |
| Molecular Weight: | 466 |
| Molecular Formula: | C22 H27 N3 O4 S |
| Salt: | HCl |
| Smiles: | CCN(CC)CCC(N1c2ccccc2S(c2ccc(cc12)NC(=O)OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1678 |
| logD: | 1.5851 |
| logSw: | -2.7997 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.853 |
| InChI Key: | TYCOHDNYAYQQMC-PMERELPUSA-N |