N-[10-(2-methoxyethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[10-(2-methoxyethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl]-2H-1,3-benzodioxole-5-carboxamide
N-[10-(2-methoxyethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | G943-1167 |
| Compound Name: | N-[10-(2-methoxyethyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 448.5 |
| Molecular Formula: | C24 H20 N2 O5 S |
| Smiles: | COCCN1C(c2ccccc2Sc2cc(ccc12)NC(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4508 |
| logD: | 4.4508 |
| logSw: | -4.2335 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.2 |
| InChI Key: | SZEFZMSUOHSHBP-UHFFFAOYSA-N |