10-ethyl-8-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-5,5,11(10H)-trione
Chemical Structure Depiction of
10-ethyl-8-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-5,5,11(10H)-trione
10-ethyl-8-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-5,5,11(10H)-trione
Compound characteristics
| Compound ID: | C530-0283 |
| Compound Name: | 10-ethyl-8-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-5,5,11(10H)-trione |
| Molecular Weight: | 503.62 |
| Molecular Formula: | C28 H29 N3 O4 S |
| Smiles: | CCN1C(c2ccccc2S(c2ccc(cc12)C(N1CCN(C(C)C1)c1cccc(C)c1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7789 |
| logD: | 3.7789 |
| logSw: | -3.9056 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.504 |
| InChI Key: | BGJDRQQYVMNXLE-FQEVSTJZSA-N |