8-[4-(furan-2-carbonyl)piperazine-1-carbonyl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
8-[4-(furan-2-carbonyl)piperazine-1-carbonyl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
8-[4-(furan-2-carbonyl)piperazine-1-carbonyl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | C791-0070 |
| Compound Name: | 8-[4-(furan-2-carbonyl)piperazine-1-carbonyl]dibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 433.48 |
| Molecular Formula: | C23 H19 N3 O4 S |
| Smiles: | C1CN(CCN1C(c1ccc2c(c1)NC(c1ccccc1S2)=O)=O)C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6052 |
| logD: | 2.6051 |
| logSw: | -3.4141 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.858 |
| InChI Key: | QCYSIKYKRFKRAC-UHFFFAOYSA-N |