N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-5-methoxy-1H-indole-2-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-5-methoxy-1H-indole-2-carboxamide
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-5-methoxy-1H-indole-2-carboxamide
Compound characteristics
| Compound ID: | S639-3440 |
| Compound Name: | N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-5-methoxy-1H-indole-2-carboxamide |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C18 H26 N4 O4 S |
| Smiles: | CN(C)C[C@@H]1CN(C[C@H]1NC(c1cc2cc(ccc2[nH]1)OC)=O)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.1181 |
| logD: | -0.8066 |
| logSw: | -2.6839 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.063 |
| InChI Key: | KAJDDIXQDKCIRH-CXAGYDPISA-N |