4-(4-fluorophenyl)-N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-fluorophenyl)-N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)piperazine-1-carboxamide
4-(4-fluorophenyl)-N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | E006-0040 |
| Compound Name: | 4-(4-fluorophenyl)-N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)piperazine-1-carboxamide |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C25 H23 F N4 O2 S |
| Smiles: | CN1C(c2ccccc2Sc2ccc(cc12)NC(N1CCN(CC1)c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5088 |
| logD: | 4.5086 |
| logSw: | -4.2355 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.167 |
| InChI Key: | ZXHVTXBTOBHRAR-UHFFFAOYSA-N |