N-(9,9-dimethyl-7-oxo-7,8,9,10-tetrahydrobenzo[b]naphtho[2,1-d]furan-5-yl)-4-methoxy-3-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-(9,9-dimethyl-7-oxo-7,8,9,10-tetrahydrobenzo[b]naphtho[2,1-d]furan-5-yl)-4-methoxy-3-nitrobenzene-1-sulfonamide
N-(9,9-dimethyl-7-oxo-7,8,9,10-tetrahydrobenzo[b]naphtho[2,1-d]furan-5-yl)-4-methoxy-3-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 6145-0994 |
| Compound Name: | N-(9,9-dimethyl-7-oxo-7,8,9,10-tetrahydrobenzo[b]naphtho[2,1-d]furan-5-yl)-4-methoxy-3-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 494.52 |
| Molecular Formula: | C25 H22 N2 O7 S |
| Smiles: | CC1(C)CC(c2c3cc(c4ccccc4c3oc2C1)NS(c1ccc(c(c1)[N+]([O-])=O)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5756 |
| logD: | 4.5492 |
| logSw: | -4.6379 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.226 |
| InChI Key: | WZJXYRBENWPBAI-UHFFFAOYSA-N |