4-chloro-N-(9,9-dimethyl-7-oxo-7,8,9,10-tetrahydrobenzo[b]naphtho[2,1-d]furan-5-yl)-3-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
4-chloro-N-(9,9-dimethyl-7-oxo-7,8,9,10-tetrahydrobenzo[b]naphtho[2,1-d]furan-5-yl)-3-nitrobenzene-1-sulfonamide
4-chloro-N-(9,9-dimethyl-7-oxo-7,8,9,10-tetrahydrobenzo[b]naphtho[2,1-d]furan-5-yl)-3-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 3461-1214 |
| Compound Name: | 4-chloro-N-(9,9-dimethyl-7-oxo-7,8,9,10-tetrahydrobenzo[b]naphtho[2,1-d]furan-5-yl)-3-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 498.94 |
| Molecular Formula: | C24 H19 Cl N2 O6 S |
| Smiles: | CC1(C)CC(c2c3cc(c4ccccc4c3oc2C1)NS(c1ccc(c(c1)[N+]([O-])=O)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.292 |
| logD: | 4.8663 |
| logSw: | -6.0917 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.596 |
| InChI Key: | ORIMDQOLIGOUOE-UHFFFAOYSA-N |