10-ethyl-8-[4-(pyridin-2-yl)piperazine-1-carbonyl]-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-5,11(10H)-dione
Chemical Structure Depiction of
10-ethyl-8-[4-(pyridin-2-yl)piperazine-1-carbonyl]-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-5,11(10H)-dione
10-ethyl-8-[4-(pyridin-2-yl)piperazine-1-carbonyl]-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-5,11(10H)-dione
Compound characteristics
| Compound ID: | C529-1876 |
| Compound Name: | 10-ethyl-8-[4-(pyridin-2-yl)piperazine-1-carbonyl]-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-5,11(10H)-dione |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C25 H24 N4 O3 S |
| Smiles: | CCN1C(c2ccccc2S(c2ccc(cc12)C(N1CCN(CC1)c1ccccn1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.437 |
| logD: | 2.4282 |
| logSw: | -2.888 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.201 |
| InChI Key: | HXPGFFXILZXAST-UHFFFAOYSA-N |