7-[4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)piperidine-1-sulfonyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Chemical Structure Depiction of
7-[4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)piperidine-1-sulfonyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
7-[4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)piperidine-1-sulfonyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Compound characteristics
| Compound ID: | E977-0548 |
| Compound Name: | 7-[4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)piperidine-1-sulfonyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one |
| Molecular Weight: | 477.58 |
| Molecular Formula: | C23 H31 N3 O6 S |
| Smiles: | C1CC(Nc2ccc(cc2C1)S(N1CCC(CC1)C(N1CCC2(CC1)OCCO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7984 |
| logD: | 0.7984 |
| logSw: | -2.4668 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.186 |
| InChI Key: | ATMCCAJDNYEUSN-UHFFFAOYSA-N |