8-chloro-2-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
8-chloro-2-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
8-chloro-2-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0069 |
| Compound Name: | 8-chloro-2-(6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 500.96 |
| Molecular Formula: | C24 H21 Cl N2 O6 S |
| Smiles: | COc1cc2CCN(Cc2cc1OC)S(c1ccc2c(c1)C(Nc1cc(ccc1O2)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2898 |
| logD: | 3.3297 |
| logSw: | -4.627 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.974 |
| InChI Key: | LIFATOSJNFKRRL-UHFFFAOYSA-N |