N-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)phenyl]-5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)phenyl]-5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
N-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)phenyl]-5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F912-0457 |
| Compound Name: | N-[3-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)phenyl]-5-[(3-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 494.57 |
| Molecular Formula: | C25 H26 N4 O5 S |
| Smiles: | Cc1cccc(c1)OCc1nnc(C(Nc2cccc(c2)C(N2CCC3(CC2)OCCO3)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.9622 |
| logD: | 2.9622 |
| logSw: | -3.3975 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.642 |
| InChI Key: | PQQIXQAYVRECJN-UHFFFAOYSA-N |