6-amino-5-(3,4-dimethoxybenzoyl)-2,3-dihydro-1H-pyrrolizine-7-carbonitrile
Chemical Structure Depiction of
6-amino-5-(3,4-dimethoxybenzoyl)-2,3-dihydro-1H-pyrrolizine-7-carbonitrile
6-amino-5-(3,4-dimethoxybenzoyl)-2,3-dihydro-1H-pyrrolizine-7-carbonitrile
Compound characteristics
| Compound ID: | 8018-8816 |
| Compound Name: | 6-amino-5-(3,4-dimethoxybenzoyl)-2,3-dihydro-1H-pyrrolizine-7-carbonitrile |
| Molecular Weight: | 311.34 |
| Molecular Formula: | C17 H17 N3 O3 |
| Smiles: | COc1ccc(cc1OC)C(c1c(c(C#N)c2CCCn12)N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9305 |
| logD: | 1.9305 |
| logSw: | -2.4514 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.073 |
| InChI Key: | RUNAWYBXPOCRKV-UHFFFAOYSA-N |