5-{(2S)-1-[(3-fluorophenyl)methyl]pyrrolidine-2-carbonyl}-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-{(2S)-1-[(3-fluorophenyl)methyl]pyrrolidine-2-carbonyl}-1,5-diazacycloundecan-2-one
5-{(2S)-1-[(3-fluorophenyl)methyl]pyrrolidine-2-carbonyl}-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S783-0154 |
| Compound Name: | 5-{(2S)-1-[(3-fluorophenyl)methyl]pyrrolidine-2-carbonyl}-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 375.49 |
| Molecular Formula: | C21 H30 F N3 O2 |
| Smiles: | C1CCCN(CCC(NCC1)=O)C([C@@H]1CCCN1Cc1cccc(c1)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.738 |
| logD: | 1.7166 |
| logSw: | -2.1287 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.2 |
| InChI Key: | IREHKUZWFMYKPB-IBGZPJMESA-N |