[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl](isoquinolin-1-yl)methanone
Chemical Structure Depiction of
[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl](isoquinolin-1-yl)methanone
[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl](isoquinolin-1-yl)methanone
Compound characteristics
| Compound ID: | S823-4227 |
| Compound Name: | [rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl](isoquinolin-1-yl)methanone |
| Molecular Weight: | 299.37 |
| Molecular Formula: | C17 H21 N3 O2 |
| Smiles: | CN(C)[C@@H]1CN(C[C@H]1CO)C(c1c2ccccc2ccn1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.6925 |
| logD: | -0.5755 |
| logSw: | -1.7183 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.693 |
| InChI Key: | QDROBGSQRPBVOX-DZGCQCFKSA-N |