5-{(2S)-1-[(5-methylfuran-2-yl)methyl]pyrrolidine-2-carbonyl}-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-{(2S)-1-[(5-methylfuran-2-yl)methyl]pyrrolidine-2-carbonyl}-1,5-diazacycloundecan-2-one
5-{(2S)-1-[(5-methylfuran-2-yl)methyl]pyrrolidine-2-carbonyl}-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S783-0145 |
| Compound Name: | 5-{(2S)-1-[(5-methylfuran-2-yl)methyl]pyrrolidine-2-carbonyl}-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 361.48 |
| Molecular Formula: | C20 H31 N3 O3 |
| Smiles: | Cc1ccc(CN2CCC[C@H]2C(N2CCCCCCNC(CC2)=O)=O)o1 |
| Stereo: | ABSOLUTE |
| logP: | 1.3544 |
| logD: | 1.2391 |
| logSw: | -2.0214 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.462 |
| InChI Key: | LETGERAHXMSJSC-SFHVURJKSA-N |