8-(4-benzylpiperazine-1-carbonyl)dibenzo[b,f][1,4]thiazepin-11(10H)-one
Chemical Structure Depiction of
8-(4-benzylpiperazine-1-carbonyl)dibenzo[b,f][1,4]thiazepin-11(10H)-one
8-(4-benzylpiperazine-1-carbonyl)dibenzo[b,f][1,4]thiazepin-11(10H)-one
Compound characteristics
| Compound ID: | C791-0110 |
| Compound Name: | 8-(4-benzylpiperazine-1-carbonyl)dibenzo[b,f][1,4]thiazepin-11(10H)-one |
| Molecular Weight: | 429.54 |
| Molecular Formula: | C25 H23 N3 O2 S |
| Smiles: | C1CN(CCN1Cc1ccccc1)C(c1ccc2c(c1)NC(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7134 |
| logD: | 3.6978 |
| logSw: | -4.0863 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.364 |
| InChI Key: | VSNHOBIGFREGRI-UHFFFAOYSA-N |