11-(2-chloro-6-fluorophenyl)-11H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-ol
Chemical Structure Depiction of
11-(2-chloro-6-fluorophenyl)-11H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-ol
11-(2-chloro-6-fluorophenyl)-11H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-ol
Compound characteristics
| Compound ID: | C472-0039 |
| Compound Name: | 11-(2-chloro-6-fluorophenyl)-11H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-ol |
| Molecular Weight: | 393.87 |
| Molecular Formula: | C22 H13 Cl F N O S |
| Smiles: | c1ccc2C3C(C(c4c(cccc4[Cl])F)Sc4ccccc4N=3)=C(c2c1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9675 |
| logD: | 3.6457 |
| logSw: | -4.6015 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.9064 |
| InChI Key: | DXNKQNFJLQFZGS-JOCHJYFZSA-N |