N-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-(3-ethylphenyl)urea
Chemical Structure Depiction of
N-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-(3-ethylphenyl)urea
N-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-(3-ethylphenyl)urea
Compound characteristics
| Compound ID: | E006-0428 |
| Compound Name: | N-(10-ethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-(3-ethylphenyl)urea |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C24 H23 N3 O2 S |
| Smiles: | CCc1cccc(c1)NC(Nc1ccc2c(c1)N(CC)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3769 |
| logD: | 6.3769 |
| logSw: | -5.556 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.7 |
| InChI Key: | QSGIPMKJMQPAPB-UHFFFAOYSA-N |