propan-2-yl 2-methyl-5-[(2-methyl-5-nitrobenzene-1-sulfonyl)amino]naphtho[1,2-b]furan-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-methyl-5-[(2-methyl-5-nitrobenzene-1-sulfonyl)amino]naphtho[1,2-b]furan-3-carboxylate
propan-2-yl 2-methyl-5-[(2-methyl-5-nitrobenzene-1-sulfonyl)amino]naphtho[1,2-b]furan-3-carboxylate
Compound characteristics
| Compound ID: | 5591-3693 |
| Compound Name: | propan-2-yl 2-methyl-5-[(2-methyl-5-nitrobenzene-1-sulfonyl)amino]naphtho[1,2-b]furan-3-carboxylate |
| Molecular Weight: | 482.51 |
| Molecular Formula: | C24 H22 N2 O7 S |
| Smiles: | CC(C)OC(c1c2cc(c3ccccc3c2oc1C)NS(c1cc(ccc1C)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5647 |
| logD: | 5.044 |
| logSw: | -5.6839 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.913 |
| InChI Key: | UVTMOVKNVCAGDB-UHFFFAOYSA-N |