N-(4-fluorophenyl)-N'-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)urea
Chemical Structure Depiction of
N-(4-fluorophenyl)-N'-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)urea
N-(4-fluorophenyl)-N'-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)urea
Compound characteristics
| Compound ID: | E006-0107 |
| Compound Name: | N-(4-fluorophenyl)-N'-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)urea |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C21 H16 F N3 O2 S |
| Smiles: | CN1C(c2ccccc2Sc2ccc(cc12)NC(Nc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9611 |
| logD: | 4.9611 |
| logSw: | -4.5392 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.741 |
| InChI Key: | PSLQIVMMYHWERV-UHFFFAOYSA-N |