N-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-(2,4,6-trimethylphenyl)urea
Chemical Structure Depiction of
N-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-(2,4,6-trimethylphenyl)urea
N-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-(2,4,6-trimethylphenyl)urea
Compound characteristics
| Compound ID: | E006-0628 |
| Compound Name: | N-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-(2,4,6-trimethylphenyl)urea |
| Molecular Weight: | 493.63 |
| Molecular Formula: | C30 H27 N3 O2 S |
| Smiles: | Cc1cc(C)c(c(C)c1)NC(Nc1ccc2c(c1)N(Cc1ccccc1)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.3699 |
| logD: | 7.3699 |
| logSw: | -5.599 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.308 |
| InChI Key: | JRSGJUWPBVPQOP-UHFFFAOYSA-N |