N-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-[(4-fluorophenyl)methyl]urea
Chemical Structure Depiction of
N-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-[(4-fluorophenyl)methyl]urea
N-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-[(4-fluorophenyl)methyl]urea
Compound characteristics
| Compound ID: | E006-0426 |
| Compound Name: | N-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-[(4-fluorophenyl)methyl]urea |
| Molecular Weight: | 421.49 |
| Molecular Formula: | C23 H20 F N3 O2 S |
| Smiles: | CCN1C(c2ccccc2Sc2ccc(cc12)NC(NCc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.832 |
| logD: | 4.832 |
| logSw: | -4.4331 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.022 |
| InChI Key: | STFXBQMOFDSDGC-UHFFFAOYSA-N |