4-methyl-2-[(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbonyl)amino]benzoic acid
Chemical Structure Depiction of
4-methyl-2-[(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbonyl)amino]benzoic acid
4-methyl-2-[(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbonyl)amino]benzoic acid
Compound characteristics
| Compound ID: | Y043-7871 |
| Compound Name: | 4-methyl-2-[(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbonyl)amino]benzoic acid |
| Molecular Weight: | 367.4 |
| Molecular Formula: | C20 H21 N3 O4 |
| Smiles: | Cc1ccc(C(O)=O)c(c1)NC(N1C[C@H]2C[C@H](C1)C1=CC=CC(N1C2)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.2267 |
| logD: | -0.464 |
| logSw: | -3.2819 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.117 |
| InChI Key: | PKTOOCFQDFTJFO-KGLIPLIRSA-N |