8-[4-(4-chlorophenyl)piperazine-1-carbonyl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
8-[4-(4-chlorophenyl)piperazine-1-carbonyl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
8-[4-(4-chlorophenyl)piperazine-1-carbonyl]dibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | C791-0079 |
| Compound Name: | 8-[4-(4-chlorophenyl)piperazine-1-carbonyl]dibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 449.96 |
| Molecular Formula: | C24 H20 Cl N3 O2 S |
| Smiles: | C1CN(CCN1C(c1ccc2c(c1)NC(c1ccccc1S2)=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7486 |
| logD: | 4.7484 |
| logSw: | -4.9804 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.084 |
| InChI Key: | JPCXWDHXYIAEKZ-UHFFFAOYSA-N |