N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]thiophene-3-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]thiophene-3-carboxamide
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | S639-3366 |
| Compound Name: | N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]thiophene-3-carboxamide |
| Molecular Weight: | 331.45 |
| Molecular Formula: | C13 H21 N3 O3 S2 |
| Smiles: | CN(C)C[C@@H]1CN(C[C@H]1NC(c1ccsc1)=O)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.1361 |
| logD: | -1.7886 |
| logSw: | -2.2765 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.188 |
| InChI Key: | WMSZHPUNQBPMQH-VXGBXAGGSA-N |