2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-8-methyldibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-8-methyldibenzo[b,f][1,4]oxazepin-11(10H)-one
2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-8-methyldibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0105 |
| Compound Name: | 2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-8-methyldibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 420.49 |
| Molecular Formula: | C23 H20 N2 O4 S |
| Smiles: | Cc1ccc2c(c1)NC(c1cc(ccc1O2)S(N1CCc2ccccc2C1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2902 |
| logD: | 4.2606 |
| logSw: | -4.2033 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.713 |
| InChI Key: | OMLUYIYJZGAHRD-UHFFFAOYSA-N |