(11aR)-3-[4-(pyridine-3-sulfonyl)piperazine-1-carbonyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
(11aR)-3-[4-(pyridine-3-sulfonyl)piperazine-1-carbonyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
(11aR)-3-[4-(pyridine-3-sulfonyl)piperazine-1-carbonyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N119-0128 |
| Compound Name: | (11aR)-3-[4-(pyridine-3-sulfonyl)piperazine-1-carbonyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C21 H29 N5 O4 S |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)C(N1CCN(CC1)S(c1cccnc1)(=O)=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.6269 |
| logD: | 0.6269 |
| logSw: | -1.6138 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.963 |
| InChI Key: | QTHCXTZWXOVIHS-YQVWRLOYSA-N |