N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-(2-phenylethyl)urea
Chemical Structure Depiction of
N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-(2-phenylethyl)urea
N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-(2-phenylethyl)urea
Compound characteristics
| Compound ID: | E006-0135 |
| Compound Name: | N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-(2-phenylethyl)urea |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C23 H21 N3 O2 S |
| Smiles: | CN1C(c2ccccc2Sc2ccc(cc12)NC(NCCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3241 |
| logD: | 4.3241 |
| logSw: | -4.2998 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.904 |
| InChI Key: | MVEXHONHGIZRPJ-UHFFFAOYSA-N |