rel-(3R,4S)-4-[1-(2-chloropropanoyl)-1,2,3,6-tetrahydropyridin-4-yl]-3-methoxy-1-[(4-methoxyphenyl)methyl]azetidin-2-one
Chemical Structure Depiction of
rel-(3R,4S)-4-[1-(2-chloropropanoyl)-1,2,3,6-tetrahydropyridin-4-yl]-3-methoxy-1-[(4-methoxyphenyl)methyl]azetidin-2-one
rel-(3R,4S)-4-[1-(2-chloropropanoyl)-1,2,3,6-tetrahydropyridin-4-yl]-3-methoxy-1-[(4-methoxyphenyl)methyl]azetidin-2-one
Compound characteristics
| Compound ID: | T003-0275 |
| Compound Name: | rel-(3R,4S)-4-[1-(2-chloropropanoyl)-1,2,3,6-tetrahydropyridin-4-yl]-3-methoxy-1-[(4-methoxyphenyl)methyl]azetidin-2-one |
| Molecular Weight: | 392.88 |
| Molecular Formula: | C20 H25 Cl N2 O4 |
| Smiles: | CC(C(N1CCC(=CC1)[C@H]1[C@H](C(N1Cc1ccc(cc1)OC)=O)OC)=O)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.8435 |
| logD: | 1.8435 |
| logSw: | -2.144 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.661 |
| InChI Key: | NKACCTPNGGCYOF-NGKGQXKNSA-N |