7-HYDROXY-2-OXO-2-ISOTHIOCHROMAN-3(+)-CARBOXYLIC ACID-{1-[4-(3-HYDROXYPHENYL)-(3R,4R)-TRANS-DIMETHYL-PIPERIDINYLMETHYL]-(2S)-METHYLPROPYL}AMIDE (DIASTEREOMERIC MIX)
7-HYDROXY-2-OXO-2-ISOTHIOCHROMAN-3(+)-CARBOXYLIC ACID-{1-[4-(3-HYDROXYPHENYL)-(3R,4R)-TRANS-DIMETHYL-PIPERIDINYLMETHYL]-(2S)-METHYLPROPYL}AMIDE (DIASTEREOMERIC MIX)
SMILES | CC(C)[C@@H](CN1CC[C@@](C)(c2cccc(O)c2)[C@@H](C)C1)NC(=O)[C@H]1Cc2ccc(O)cc2C[S+]1[O-] |
InChIKey | UDCUABBHLILTLQ-CPTSUUKUSA-N |
Chemical Properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 3 |
Rotatable bonds | 6 |
Molecular weight (Da) | 498.3 |
Database connections
No bioactivity data available.
7-HYDROXY-2-OXO-2-ISOTHIOCHROMAN-3(+)-CARBOXYLIC ACID-{1-[4-(3-HYDROXYPHENYL)-(3R,4R)-TRANS-DIMETHYL-PIPERIDINYLMETHYL]-(2S)-METHYLPROPYL}AMIDE (DIASTEREOMERIC MIX)
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV