N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)-N-(2,4,5-trimethylbenzene-1-sulfonyl)pyridine-4-carboxamide
Chemical Structure Depiction of
N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)-N-(2,4,5-trimethylbenzene-1-sulfonyl)pyridine-4-carboxamide
N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)-N-(2,4,5-trimethylbenzene-1-sulfonyl)pyridine-4-carboxamide
Compound characteristics
| Compound ID: | 6807-0742 |
| Compound Name: | N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)-N-(2,4,5-trimethylbenzene-1-sulfonyl)pyridine-4-carboxamide |
| Molecular Weight: | 504.58 |
| Molecular Formula: | C26 H20 N2 O5 S2 |
| Smiles: | Cc1cc(C)c(cc1C)S(N(C(c1ccncc1)=O)c1cc2c(c3ccccc13)OC(=O)S2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3003 |
| logD: | 5.3003 |
| logSw: | -5.6521 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 76.158 |
| InChI Key: | PFHONTIVUVYHSQ-UHFFFAOYSA-N |