N-[(4-fluorophenyl)methyl]-1,4,11-trimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-1,4,11-trimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[(4-fluorophenyl)methyl]-1,4,11-trimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C700-0839 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-1,4,11-trimethyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C24 H21 F N2 O S |
| Smiles: | CC1c2c(C)ccc(C)c2Sc2ccc(cc2N=1)C(NCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3533 |
| logD: | 5.3528 |
| logSw: | -5.452 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.914 |
| InChI Key: | FMIWXMPERMSUBP-UHFFFAOYSA-N |