5-{1-[(3-methylthiophen-2-yl)methyl]piperidine-4-carbonyl}-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-{1-[(3-methylthiophen-2-yl)methyl]piperidine-4-carbonyl}-1,5-diazacycloundecan-2-one
5-{1-[(3-methylthiophen-2-yl)methyl]piperidine-4-carbonyl}-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S790-0171 |
| Compound Name: | 5-{1-[(3-methylthiophen-2-yl)methyl]piperidine-4-carbonyl}-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 391.58 |
| Molecular Formula: | C21 H33 N3 O2 S |
| Smiles: | Cc1ccsc1CN1CCC(CC1)C(N1CCCCCCNC(CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1771 |
| logD: | -0.1828 |
| logSw: | -2.5275 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.992 |
| InChI Key: | FQEVHWUKROMZBZ-UHFFFAOYSA-N |