5-[1-(3-methoxypropyl)-2,5-dimethyl-1H-pyrrole-3-carbonyl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-[1-(3-methoxypropyl)-2,5-dimethyl-1H-pyrrole-3-carbonyl]-1,5-diazacycloundecan-2-one
5-[1-(3-methoxypropyl)-2,5-dimethyl-1H-pyrrole-3-carbonyl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S782-0103 |
| Compound Name: | 5-[1-(3-methoxypropyl)-2,5-dimethyl-1H-pyrrole-3-carbonyl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 363.5 |
| Molecular Formula: | C20 H33 N3 O3 |
| Smiles: | Cc1cc(C(N2CCCCCCNC(CC2)=O)=O)c(C)n1CCCOC |
| Stereo: | ACHIRAL |
| logP: | 1.2411 |
| logD: | 1.2411 |
| logSw: | -1.9394 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.755 |
| InChI Key: | AEYQRDLCBNYHNT-UHFFFAOYSA-N |