8-[4-(3-chlorophenyl)piperazine-1-carbonyl]-10-ethyl-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-5,5,11(10H)-trione
Chemical Structure Depiction of
8-[4-(3-chlorophenyl)piperazine-1-carbonyl]-10-ethyl-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-5,5,11(10H)-trione
8-[4-(3-chlorophenyl)piperazine-1-carbonyl]-10-ethyl-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-5,5,11(10H)-trione
Compound characteristics
| Compound ID: | C530-0278 |
| Compound Name: | 8-[4-(3-chlorophenyl)piperazine-1-carbonyl]-10-ethyl-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-5,5,11(10H)-trione |
| Molecular Weight: | 510.01 |
| Molecular Formula: | C26 H24 Cl N3 O4 S |
| Smiles: | CCN1C(c2ccccc2S(c2ccc(cc12)C(N1CCN(CC1)c1cccc(c1)[Cl])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4826 |
| logD: | 3.4826 |
| logSw: | -3.8257 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.286 |
| InChI Key: | YSSSDLGMQRTOSM-UHFFFAOYSA-N |