N-[4-(diethylamino)-2-methylphenyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[4-(diethylamino)-2-methylphenyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[4-(diethylamino)-2-methylphenyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C791-0125 |
| Compound Name: | N-[4-(diethylamino)-2-methylphenyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 431.56 |
| Molecular Formula: | C25 H25 N3 O2 S |
| Smiles: | CCN(CC)c1ccc(c(C)c1)NC(c1ccc2c(c1)NC(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3754 |
| logD: | 5.1622 |
| logSw: | -5.3001 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.305 |
| InChI Key: | MSXISJZXEOSNLD-UHFFFAOYSA-N |