N-(4-bromobenzene-1-sulfonyl)-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)pyridine-4-carboxamide
Chemical Structure Depiction of
N-(4-bromobenzene-1-sulfonyl)-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)pyridine-4-carboxamide
N-(4-bromobenzene-1-sulfonyl)-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)pyridine-4-carboxamide
Compound characteristics
| Compound ID: | 6807-0731 |
| Compound Name: | N-(4-bromobenzene-1-sulfonyl)-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)pyridine-4-carboxamide |
| Molecular Weight: | 541.4 |
| Molecular Formula: | C23 H13 Br N2 O5 S2 |
| Smiles: | c1ccc2c3c(cc(c2c1)N(C(c1ccncc1)=O)S(c1ccc(cc1)[Br])(=O)=O)SC(=O)O3 |
| Stereo: | ACHIRAL |
| logP: | 4.7757 |
| logD: | 4.7757 |
| logSw: | -5.1182 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 76.158 |
| InChI Key: | OAABLHSGPOKOMP-UHFFFAOYSA-N |