N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)-N-(thiophene-2-sulfonyl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)-N-(thiophene-2-sulfonyl)cyclohexanecarboxamide
N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)-N-(thiophene-2-sulfonyl)cyclohexanecarboxamide
Compound characteristics
| Compound ID: | 6807-1039 |
| Compound Name: | N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)-N-(thiophene-2-sulfonyl)cyclohexanecarboxamide |
| Molecular Weight: | 473.59 |
| Molecular Formula: | C22 H19 N O5 S3 |
| Smiles: | C1CCC(CC1)C(N(c1cc2c(c3ccccc13)OC(=O)S2)S(c1cccs1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2525 |
| logD: | 5.2525 |
| logSw: | -5.6169 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.941 |
| InChI Key: | KRMHKZDSXPBXMF-UHFFFAOYSA-N |