10-[(4-fluorophenyl)methyl]-8-(4-methylpiperazine-1-carbonyl)-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-5,11(10H)-dione
Chemical Structure Depiction of
10-[(4-fluorophenyl)methyl]-8-(4-methylpiperazine-1-carbonyl)-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-5,11(10H)-dione
10-[(4-fluorophenyl)methyl]-8-(4-methylpiperazine-1-carbonyl)-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-5,11(10H)-dione
Compound characteristics
| Compound ID: | C529-0814 |
| Compound Name: | 10-[(4-fluorophenyl)methyl]-8-(4-methylpiperazine-1-carbonyl)-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-5,11(10H)-dione |
| Molecular Weight: | 477.56 |
| Molecular Formula: | C26 H24 F N3 O3 S |
| Smiles: | CN1CCN(CC1)C(c1ccc2c(c1)N(Cc1ccc(cc1)F)C(c1ccccc1S2=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2833 |
| logD: | 2.1526 |
| logSw: | -3.0277 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.91 |
| InChI Key: | DZGOKRAQDIBLDK-UHFFFAOYSA-N |