N-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-{4-[(morpholin-4-yl)methyl]phenyl}urea
Chemical Structure Depiction of
N-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-{4-[(morpholin-4-yl)methyl]phenyl}urea
N-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-{4-[(morpholin-4-yl)methyl]phenyl}urea
Compound characteristics
| Compound ID: | E006-0528 |
| Compound Name: | N-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-{4-[(morpholin-4-yl)methyl]phenyl}urea |
| Molecular Weight: | 488.61 |
| Molecular Formula: | C27 H28 N4 O3 S |
| Smiles: | CCN1C(c2ccccc2Sc2ccc(cc12)NC(Nc1ccc(CN2CCOCC2)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9283 |
| logD: | 4.8728 |
| logSw: | -4.3803 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.341 |
| InChI Key: | HHBGSCNJYSIYBY-UHFFFAOYSA-N |