11-(2-bromophenyl)-11H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-ol
Chemical Structure Depiction of
11-(2-bromophenyl)-11H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-ol
11-(2-bromophenyl)-11H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-ol
Compound characteristics
| Compound ID: | C472-0009 |
| Compound Name: | 11-(2-bromophenyl)-11H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-ol |
| Molecular Weight: | 420.33 |
| Molecular Formula: | C22 H14 Br N O S |
| Smiles: | c1ccc2C3C(C(c4ccccc4[Br])Sc4ccccc4N=3)=C(c2c1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1842 |
| logD: | 3.8624 |
| logSw: | -5.2349 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.9064 |
| InChI Key: | PSQBLSGMBTXZHU-JOCHJYFZSA-N |