3-(3,4-dihydroisoquinolin-2(1H)-yl)-N,N,8-trimethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Chemical Structure Depiction of
3-(3,4-dihydroisoquinolin-2(1H)-yl)-N,N,8-trimethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
3-(3,4-dihydroisoquinolin-2(1H)-yl)-N,N,8-trimethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Compound characteristics
| Compound ID: | J030-0809 |
| Compound Name: | 3-(3,4-dihydroisoquinolin-2(1H)-yl)-N,N,8-trimethyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C25 H25 N3 O4 S |
| Smiles: | Cc1ccc2c(c1)NC(c1cc(c(cc1O2)N1CCc2ccccc2C1)S(N(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4631 |
| logD: | 4.4169 |
| logSw: | -4.2638 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.817 |
| InChI Key: | DFZASQQXHBJTQU-UHFFFAOYSA-N |