N-(3-methylbutyl)-11-oxo-10-(prop-2-en-1-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-(3-methylbutyl)-11-oxo-10-(prop-2-en-1-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
N-(3-methylbutyl)-11-oxo-10-(prop-2-en-1-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | K784-7763 |
| Compound Name: | N-(3-methylbutyl)-11-oxo-10-(prop-2-en-1-yl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 380.51 |
| Molecular Formula: | C22 H24 N2 O2 S |
| Smiles: | CC(C)CCNC(c1ccc2c(c1)N(CC=C)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7546 |
| logD: | 4.7546 |
| logSw: | -4.3519 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.177 |
| InChI Key: | YEFUMFTWAMQNHA-UHFFFAOYSA-N |