rel-(1R,4S,6S)-N-(4-chloro-2-fluorophenyl)-6-[(thiophene-2-sulfonyl)amino]-2-azabicyclo[2.2.1]heptane-2-carboxamide
Chemical Structure Depiction of
rel-(1R,4S,6S)-N-(4-chloro-2-fluorophenyl)-6-[(thiophene-2-sulfonyl)amino]-2-azabicyclo[2.2.1]heptane-2-carboxamide
rel-(1R,4S,6S)-N-(4-chloro-2-fluorophenyl)-6-[(thiophene-2-sulfonyl)amino]-2-azabicyclo[2.2.1]heptane-2-carboxamide
Compound characteristics
| Compound ID: | S033-1491 |
| Compound Name: | rel-(1R,4S,6S)-N-(4-chloro-2-fluorophenyl)-6-[(thiophene-2-sulfonyl)amino]-2-azabicyclo[2.2.1]heptane-2-carboxamide |
| Molecular Weight: | 429.92 |
| Molecular Formula: | C17 H17 Cl F N3 O3 S2 |
| Smiles: | C1[C@@H]2C[C@H]([C@H]1NS(c1cccs1)(=O)=O)N(C2)C(Nc1ccc(cc1F)[Cl])=O |
| Stereo: | RELATIVE |
| logP: | 3.7978 |
| logD: | 3.7977 |
| logSw: | -4.3645 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.799 |
| InChI Key: | SJYZAMLSUSVCAW-VQISRLSMSA-N |