N-[(4-ethoxyphenyl)methyl]-N'-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)urea
Chemical Structure Depiction of
N-[(4-ethoxyphenyl)methyl]-N'-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)urea
N-[(4-ethoxyphenyl)methyl]-N'-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)urea
Compound characteristics
| Compound ID: | E006-0281 |
| Compound Name: | N-[(4-ethoxyphenyl)methyl]-N'-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)urea |
| Molecular Weight: | 433.53 |
| Molecular Formula: | C24 H23 N3 O3 S |
| Smiles: | CCOc1ccc(CNC(Nc2ccc3c(c2)N(C)C(c2ccccc2S3)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5176 |
| logD: | 4.5176 |
| logSw: | -4.2552 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.187 |
| InChI Key: | AAJYPLYCMHMOJW-UHFFFAOYSA-N |