N-[2-(cyclohex-1-en-1-yl)ethyl]-N'-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)urea
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-N'-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)urea
N-[2-(cyclohex-1-en-1-yl)ethyl]-N'-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)urea
Compound characteristics
| Compound ID: | E006-0447 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-N'-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)urea |
| Molecular Weight: | 421.56 |
| Molecular Formula: | C24 H27 N3 O2 S |
| Smiles: | CCN1C(c2ccccc2Sc2ccc(cc12)NC(NCCC1CCCCC=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3489 |
| logD: | 5.3489 |
| logSw: | -5.1446 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.056 |
| InChI Key: | BGUDCHVCKGBLGA-UHFFFAOYSA-N |