N-(3-chloro-4-methylphenyl)-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluorobenzamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluorobenzamide
N-(3-chloro-4-methylphenyl)-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluorobenzamide
Compound characteristics
| Compound ID: | K781-7968 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2-fluorobenzamide |
| Molecular Weight: | 468.93 |
| Molecular Formula: | C21 H22 Cl F N2 O5 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(c1cc(ccc1F)S(N1CCC2(CC1)OCCO2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2551 |
| logD: | 4.0473 |
| logSw: | -4.5332 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.477 |
| InChI Key: | WJCAVZJWKRQKDF-UHFFFAOYSA-N |