rel-(1R,4R,5R)-N-(3-fluoro-4-methoxyphenyl)-5-[(thiophene-2-carbonyl)amino]-2-azabicyclo[2.2.1]heptane-2-carboxamide
Chemical Structure Depiction of
rel-(1R,4R,5R)-N-(3-fluoro-4-methoxyphenyl)-5-[(thiophene-2-carbonyl)amino]-2-azabicyclo[2.2.1]heptane-2-carboxamide
rel-(1R,4R,5R)-N-(3-fluoro-4-methoxyphenyl)-5-[(thiophene-2-carbonyl)amino]-2-azabicyclo[2.2.1]heptane-2-carboxamide
Compound characteristics
| Compound ID: | S034-2049 |
| Compound Name: | rel-(1R,4R,5R)-N-(3-fluoro-4-methoxyphenyl)-5-[(thiophene-2-carbonyl)amino]-2-azabicyclo[2.2.1]heptane-2-carboxamide |
| Molecular Weight: | 389.45 |
| Molecular Formula: | C19 H20 F N3 O3 S |
| Smiles: | COc1ccc(cc1F)NC(N1C[C@@H]2C[C@H]1C[C@@H]2NC(c1cccs1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9296 |
| logD: | 2.9296 |
| logSw: | -3.5557 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.745 |
| InChI Key: | OTMFQWLYQUICML-WHOFXGATSA-N |